Sugi Predict

Sugi Predict / Compounds / SCHEMBL545661

SCHEMBL545661

SCHEMBL545661

COc1ccc(C=O)c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.54
▸ LMNA P02545 2/20 0.54
▸ IDO1 P14902 1/20 0.52
▸ IMPDH2 P12268 1/20 0.52
▸ IMPDH1 P20839 1/20 0.52
▸ CAPN1 P07384 1/20 0.51
▸ CTSL P07711 1/20 0.51
▸ CTSB P07858 1/20 0.51
▸ ABCB1 P08183 1/20 0.51
▸ MEN1 O00255 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ MCL1 Q07820 1/20 0.50
▸ EP300 Q09472 1/20 0.50
▸ KAT8 Q9H7Z6 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ ALDH1A1 P00352 3/20 0.48
▸ TLR2 O60603 1/20 0.47
▸ ERN1 O75460 1/20 0.47
▸ TLR1 Q15399 1/20 0.47

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
SCHEMBL29708066 1.00 MAPT (0.54) MAPTLMNAIDO1IMPDH2IMPDH1
Acrylic Acid SCHEMBL11696395 0.88 CAPN1 (0.50) MAPTLMNAIDO1IMPDH2IMPDH1
SCHEMBL31362059 0.88 ERN1 (0.61) MAPTLMNAIDO1IMPDH2IMPDH1
SCHEMBL2988767 0.88 ERN1 (0.61) MAPTLMNAIDO1IMPDH2IMPDH1
SCHEMBL7710242 0.87 MCL1 (0.48) MAPTLMNAIDO1IMPDH2IMPDH1
Glycine SCHEMBL8206223 0.86 CAPN1 (0.48) MAPTLMNAIDO1IMPDH2IMPDH1
Cuminaldehyde SCHEMBL7526332 0.84 TYR (0.54) MAPTLMNAIDO1IMPDH2IMPDH1
Cyclohexylamine SCHEMBL7798292 0.83 MAPT (0.42) MAPTLMNAIDO1IMPDH2IMPDH1
SCHEMBL10969530 0.82 MAPT (0.56) MAPTLMNAIDO1IMPDH2IMPDH1
SCHEMBL28579916 0.82 ERN1 (0.46) MAPTLMNAIDO1IMPDH2IMPDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11918671-B2 Multi-tone hair dyeing method in three steps HENKEL AG & CO. KGAA (DE) 2024-03-05 — — US claimed
US-20230031764-A1 MULTI-TONE HAIR DYEING METHOD IN THREE STEPS HENKEL AG & CO. KGAA (DE) 2023-02-02 — — US claimed
US-20220257483-A1 INCREASING THE STABILITY OF AGENTS FOR TREATING KERATIN MATERIAL HENKEL AG & CO. KGAA (DE) 2022-08-18 — — US claimed
CN-114746069-A Three-step multi-tone hair dyeing method 汉高股份有限及两合公司 2022-07-12 — — CN claimed
EP-4003286-A1 INCREASING THE STABILITY OF AGENTS FOR TREATING KERATIN MATERIAL Henkel AG & Co. KGaA (DE) 2022-06-01 — — EP claimed
CN-114173750-A Improving the stability of agents for treating keratin materials 汉高股份有限及两合公司 2022-03-11 — — CN claimed
WO-2021110306-A1 MULTI-TONE HAIR DYEING METHOD IN THREE STEPS HENKEL AG & CO. KGAA (DE) 2021-06-10 — — WO claimed
WO-2021013420-A1 INCREASING THE STABILITY OF AGENTS FOR TREATING KERATIN MATERIAL HENKEL AG & CO. KGAA (DE) 2021-01-28 — — WO claimed
EP-2499484-B1 MATERIAL AND METHOD FOR TRAPPING, DETECTING AND QUANTIFYING AROMATIC HETEROCYCLIC COMPOUNDS AND OTHERS COMMISSARIAT L ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2017-06-28 — — EP claimed
CN-104292117-B Acid-sensitive connects the synthesis of unit and the purposes in DNA sequencing thereof 上海交通大学 2016-10-05 — — CN claimed
WO-2001062219-A1 AGENT FOR DYEING FIBRES COMPRISING AN INDOLINE/INDOLIUM DERIVATIVE WELLA AKTIENGESELLSCHAFT (DE) 2001-08-30 — — WO claimed
WO-2001034106-A1 AGENT FOR COLOURING KERATIN CONTAINING FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-05-17 — — WO claimed
WO-2001028507-A1 AGENT AND METHOD FOR COLOURING FIBRES WELLA AKTIENGESELLSCHAFT (DE) 2001-04-26 — — WO claimed
EP-1076649-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 2001-02-21 — — EP claimed
EP-1054657-A1 AGENT FOR COLORING FIBERS Wella Aktiengesellschaft (DE) 2000-11-29 — — EP claimed
US-6127381-A A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY LION BIOSCIENCE AG (DE) 2000-10-03 — — US claimed
WO-2000033799-A1 AGENT FOR COLORING FIBERS WELLA AKTIENGESELLSCHAFT (DE) 2000-06-15 — — WO claimed
WO-1999055679-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 1999-11-04 — — WO claimed
US-5162203-A Aromatic aldehyde substrates PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1992-11-10 — — US claimed
US-4354904-A Electrochemical oxidation of alkyl aromatic compounds UOP INC. (US) 1982-10-19 — — US claimed

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

For each of this compound's patents that has machine-readable text (3 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-20220257483-A1 INCREASING THE STABILITY OF AGENTS FOR TREATING KERATIN MATERIAL KRT18, VIM, CDH1 MAPT 1677/4885LMNA 47/4885IDO1 3570/4885
US-11918671-B2 Multi-tone hair dyeing method in three steps TYR, HAO2, HAAO MAPT 2879/4885LMNA 2896/4885IDO1 51/4885
US-20230031764-A1 MULTI-TONE HAIR DYEING METHOD IN THREE STEPS TYR, HAO2, HAAO MAPT 2879/4885LMNA 2896/4885IDO1 51/4885

“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.