SCHEMBL40312

SCHEMBL40312

O=Cc1cc(Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.60
TSHR P16473 1/20 0.60
ERN1 O75460 2/20 0.50
BACE1 P56817 1/20 0.50
VCAM1 P19320 2/20 0.49
TDP1 Q9NUW8 1/20 0.48
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPT P10636 1/20 0.47
ALOX15 P16050 1/20 0.47
PRKDC P78527 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PDE7A Q13946 4/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PDE7B Q9NP56 1/20 0.43

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
SCHEMBL29546973 1.00 MAPK1 (0.60) MAPK1TSHRERN1BACE1VCAM1
SCHEMBL27623490 0.93 MAPK1 (0.53) MAPK1TSHRERN1BACE1VCAM1
SCHEMBL8806521 0.86 ALDH1A1 (0.48) MAPK1TSHRERN1BACE1VCAM1
SCHEMBL3498042 0.86 TSHR (0.49) MAPK1TSHRERN1BACE1VCAM1
SCHEMBL29708112 0.85 MAPK1 (0.55) MAPK1TSHRERN1VCAM1TDP1
SCHEMBL203086 0.85 MAPK1 (0.55) MAPK1TSHRERN1VCAM1TDP1
SCHEMBL6782825 0.83 TSHR (0.46) MAPK1TSHRERN1BACE1VCAM1
SCHEMBL16961813 0.83 MAPK1 (0.58) MAPK1TSHRBACE1VCAM1LMNA
SCHEMBL16952297 0.83 MAPK1 (0.58) MAPK1TSHRBACE1VCAM1TDP1
SCHEMBL6377970 0.83 MAPK1 (0.58) MAPK1TSHRBACE1VCAM1TDP1

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 1003 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110590561-B Herbicidal ether hapten, artificial antigen and antibody as well as preparation method and application thereof 北京勤邦生物技术有限公司 2022-08-19 CN claimed
US-20220257483-A1 INCREASING THE STABILITY OF AGENTS FOR TREATING KERATIN MATERIAL HENKEL AG & CO. KGAA (DE) 2022-08-18 US 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
CN-109651189-B Benzoyl hydrazone neuraminidase inhibitor and preparation method and application thereof 上海应用技术大学 2021-11-19 CN claimed
WO-2021013420-A1 INCREASING THE STABILITY OF AGENTS FOR TREATING KERATIN MATERIAL HENKEL AG & CO. KGAA (DE) 2021-01-28 WO claimed
CN-107522766-B Ursolic acid quinolyl hydrazide derivatives with anti-tumor activity and preparation method and application thereof 南京林业大学 2020-03-27 CN claimed
US-20130190500-A1 PROCESS TO PREPARE 6-CHLORO-3-AMINO-2-(2-HYDROXYPROPYL)-1-AZANAPHTHALENE NEURON SYSTEMS, INC. (US) 2013-07-25 US claimed
CN-102659611-A Method for preparing 2-amino-5-chloro-2',6'-difluorobenzophenone ZHEJIANG QIMING BIOCHEMICAL TECHNOLOGY CO LTD 2012-09-12 CN claimed
EP-1778176-B1 COMPOSITION FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2012-07-25 EP claimed
WO-2003030845-A1 AGENT FOR THE COLORATION OF KERATIN-CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-04-17 WO claimed
EP-1300132-A2 Agent for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2003-04-09 EP claimed
EP-1300133-A2 Agent for dyeing keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2003-04-09 EP claimed
US-6448413-B1 17-HYDROXY-17-METHYL-1,3-SECO-2-NOR-5-ANDROSTANE-3-ACID DERIVATIVES FROM MESTANOLONE AND AROMATIC NITRO-ALDEHYDE RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2002-09-10 US claimed
EP-1189885-A1 PROCESS FOR THE SYNTHESIS OF A-NOR-SECO COMPOUNDS WITH STERANE SKELETON RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 2002-03-27 EP claimed
WO-2000076968-A1 PROCESS FOR THE SYNTHESIS OF A-NOR-SECO COMPOUNDS WITH STERANE SKELETON Richter Gedeon Vegyészeti Gyár Rt. (HU) 2000-12-21 WO claimed
WO-2000038634-A1 AGENT FOR DYING KERATIN FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-07-06 WO claimed
US-4456772-A Process for the preparation of optionally substituted fluoro-nitro-benzaldehydes BAYER AKTIENGESELLSCHAFT (DE) 1984-06-26 US claimed
US-4380629-A Styryl-like compounds showing a color-developing and bleaching behavior with improved stability and prolonged lifetime MATSUSHITA ELECTRIC INDUSTRIAL COMPANY, LIMITED (JP) 1983-04-19 US claimed
US-4147862-A Method of preparing styryl-like compounds MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1979-04-03 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 (2 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 MAPK1 2440/4885TSHR 4846/4885ERN1 2313/4885
US-20130190500-A1 PROCESS TO PREPARE 6-CHLORO-3-AMINO-2-(2-HYDROXYPROPYL)-1-AZANAPHTHALENE AZI2, DNMT1, TPMT MAPK1 1678/4885TSHR 3185/4885ERN1 4393/4885

“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.