SCHEMBL1700875

SCHEMBL1700875

O=C(O)N1CCCC1=O.[Mn]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
KMT2A Q03164 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2D6 P10635 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
RECQL P46063 1/20 0.43
BLM P54132 1/20 0.43
ALDH1A1 P00352 2/20 0.41
BRD4 O60885 1/20 0.41
BRD2 P25440 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.38
MITF O75030 1/20 0.38
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL59155 0.98
SCHEMBL1857819 0.95 LMNA (0.59) LMNAKMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL3620504 0.95 LMNA (0.59) LMNAKMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL10872417 0.95 LMNA (0.59) LMNAKMT2ACYP1A2CYP2D6CYP2C9
Ammonia Solution, Strong SCHEMBL4654664 0.95 LMNA (0.59) LMNAKMT2ACYP1A2CYP2D6CYP2C9
Water SCHEMBL1277045 0.95 LMNA (0.59) LMNAKMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL2297517 0.95 LMNA (0.59) LMNAKMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL10871994 0.95 LMNA (0.59) LMNAKMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL839318 0.95 LMNA (0.59) LMNAKMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL239942 0.95 LMNA (0.59) LMNAKMT2ACYP1A2CYP2D6CYP2C9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 113 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020142606-A1 CATALYTIC SYSTEMS, METHODS, AND ARTICLES FOR DELIVERY OF OXYGEN TO SKIN L'OREAL (FR) 2020-07-09 WO claimed
US-20200214945-A1 SKIN-BRIGHTENING COSMETIC MASK SYSTEM L'OREAL (FR) 2020-07-09 US claimed
US-10391047-B2 Mouthrinse formulations comprising fluoride and a metal salt of pyrrolidone carboxylic acid COLGATE-PALMOLIVE COMPANY (US) 2019-08-27 US claimed
US-20170348216-A1 Mouthrinse Formulations Comprising Fluoride and a Metal Salt of Pyrrolidone Carboxylic Acid GABA INTERNATIONAL HOLDING GMBH (CH) 2017-12-07 US claimed
EP-3223781-A1 MOUTHRINSE FORMULATIONS COMPRISING FLUORIDE AND A METAL SALT OF PYRROLIDONE CARBOXYLIC ACID GABA International Holding GmbH (CH) 2017-10-04 EP claimed
WO-2016096028-A1 MOUTHRINSE FORMULATIONS COMPRISING FLUORIDE AND A METAL SALT OF PYRROLIDONE CARBOXYLIC ACID GABA INTERNATIONAL HOLDING AG (CH) 2016-06-23 WO claimed
CN-118660903-A Lipolytic peptides 瓦尔德西布伦大学医院基金会研究所 2024-09-17 CN disclosed
US-11504312-B2 Mouthrinse formulations COLGATE-PALMOLIVE COMPANY (US) 2022-11-22 US disclosed
EP-3233203-B1 DYEING PROCESS STARTING FROM ORTHO-DIPHENOL OREAL (FR) 2021-11-24 EP disclosed
EP-3220886-B1 COMPOSITION COMPRISING AN ORTHO-DIPHENOL DERIVATIVE, AN ALKALI METAL (BI)CARBONATE, A WATER-SOLUBLE ORGANIC SOLVENT AND A REDUCING AGENT OREAL (FR) 2021-04-28 EP disclosed
EP-3787592-A1 COMBINATION OF EXTRACTS OF QUINQUINA AND OF LEONTOPODIUM ALPINUM AND OF THE MANGANESE SALT OF L-PYRROLIDONECARBOXYLIC ACID IN THE TREATMENT OF ALOPECIA Pierre Fabre Dermo-Cosmétique (FR) 2021-03-10 EP disclosed
CN-107249556-B Mouthwash formulation comprising fluoride and metal salt of pyrrolidone carboxylic acid 加巴国际股份有限公司 2020-09-01 CN disclosed
WO-2020142606-A1 CATALYTIC SYSTEMS, METHODS, AND ARTICLES FOR DELIVERY OF OXYGEN TO SKIN L'OREAL (FR) 2020-07-09 WO disclosed
US-7857866-B2 Dyeing method using a composition comprising an ortho-diphenol and comprising a wiping, drying or non rinsing stage L'OREAL S.A. (FR) 2010-12-28 US disclosed
US-7833290-B2 Composition comprising a derivative of hermatoxylin, of hematein, of brazilin or of brazilein, metal salt, hydrogen peroxide, and (bi)carbonate and hair dyeing method therewith L'OREAL S. A. (FR) 2010-11-16 US disclosed
US-20100154138-A1 DYEING METHOD USING A COMPOSITION COMPRISING AN ORTHO-DIPHENOL AND COMPRISING A WIPING, DRYING OR NON RINSING STAGE L'OREAL S.A. (FR) 2010-06-24 US disclosed
US-20100154143-A1 COSMETIC COMPOSITION COMPRISING AT LEAST ONE ORTHO-DIPHENOL, METAL SALT, HYDROGEN PEROXIDE, (BI)CARBONATE AND SURFACE-ACTIVE AGENT, AND DYEING METHOD THEREWITH L'OREAL S.A. (FR) 2010-06-24 US disclosed
US-20100154144-A1 COMPOSITION COMPRISING AT LEAST ONE ORTHO-DIPHENOL, ONE METAL SALT, HYDROGEN PEROXIDE, (BI)CARBONATE AND A BASIFYING AGENT AND HAIR DYEING METHOD THEREWITH L'OREAL S.A. (FR) 2010-06-24 US disclosed
US-20100150857-A1 COMPOSITION COMPRISING AT LEAST ONE ORTHO-DIPHENOL, METAL SALT, HYDROGEN PEROXIDE AND (BI)CARBONATE AND HAIR DYEING METHOD THEREWITH L'OREAL S.A. (FR) 2010-06-17 US disclosed
US-20100146718-A1 COMPOSITION COMPRISING A DERIVATIVE OF HERMATOXYLIN, OF HEMATEIN, OF BRAZILIN OR OF BRAZILEIN, METAL SALT, HYDROGEN PEROXIDE, AND (BI)CARBONATE AND HAIR DYEING METHOD THEREWITH L'OREAL S.A. (FR) 2010-06-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100154144-A1 COMPOSITION COMPRISING AT LEAST ONE ORTHO-DIPHENOL, ONE METAL SALT, HYDROGEN PEROXIDE, (BI)CARBONATE AND A BASIFYING AGENT AND HAIR DYEING METHOD THEREWITH DSG1, KRT18, DSP LMNA 2198/4885KMT2A 2046/4885CYP1A2 875/4885
US-20100154138-A1 DYEING METHOD USING A COMPOSITION COMPRISING AN ORTHO-DIPHENOL AND COMPRISING A WIPING, DRYING OR NON RINSING STAGE DSG1, KRT18, DSP LMNA 2756/4885KMT2A 1715/4885CYP1A2 2043/4885
US-20100146718-A1 COMPOSITION COMPRISING A DERIVATIVE OF HERMATOXYLIN, OF HEMATEIN, OF BRAZILIN OR OF BRAZILEIN, METAL SALT, HYDROGEN PEROXIDE, AND (BI)CARBONATE AND HAIR DYEING METHOD THEREWITH KRT18, ALPG, BSG LMNA 2282/4885KMT2A 2644/4885CYP1A2 3634/4885
US-10391047-B2 Mouthrinse formulations comprising fluoride and a metal salt of pyrrolidone carboxylic acid PHPT1, NHERF1, PHF6 LMNA 4744/4885KMT2A 1872/4885CYP1A2 1777/4885
US-20170348216-A1 Mouthrinse Formulations Comprising Fluoride and a Metal Salt of Pyrrolidone Carboxylic Acid PHPT1, P4HA1, NHERF1 LMNA 4733/4885KMT2A 2197/4885CYP1A2 2308/4885
US-20100150857-A1 COMPOSITION COMPRISING AT LEAST ONE ORTHO-DIPHENOL, METAL SALT, HYDROGEN PEROXIDE AND (BI)CARBONATE AND HAIR DYEING METHOD THEREWITH DSG1, POLR1C, DSP LMNA 2708/4885KMT2A 2881/4885CYP1A2 2202/4885
US-20100154143-A1 COSMETIC COMPOSITION COMPRISING AT LEAST ONE ORTHO-DIPHENOL, METAL SALT, HYDROGEN PEROXIDE, (BI)CARBONATE AND SURFACE-ACTIVE AGENT, AND DYEING METHOD THEREWITH DSG1, KRT18, DSP LMNA 3488/4885KMT2A 2131/4885CYP1A2 2410/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.