SCHEMBL619686

SCHEMBL619686

Nc1ccc(Oc2cccc(C(=O)O)c2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.77
KMO O15229 1/20 0.64
ALDH1A1 P00352 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
MITF O75030 1/20 0.63
GAA P10253 1/20 0.63
MAPT P10636 1/20 0.63
GFER P55789 1/20 0.63
NLRP1 Q9C000 1/20 0.63
NOD2 Q9HC29 1/20 0.63
KDM4E B2RXH2 1/20 0.63
PARP10 Q53GL7 2/20 0.60
TNKS O95271 1/20 0.60
PARP15 Q460N3 1/20 0.60
PARP14 Q460N5 1/20 0.60
TNKS2 Q9H2K2 1/20 0.60
PARP2 Q9UGN5 1/20 0.60
NPC1 O15118 2/20 0.58

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
SCHEMBL30266789 0.91 AKR1C3 (0.92) AKR1C3KMOALDH1A1KDM4EPARP10
SCHEMBL1042631 0.91 AKR1C3 (0.92) AKR1C3KMOALDH1A1KDM4EPARP10
SCHEMBL6866104 0.90 MEN1 (0.69) AKR1C3KMOALDH1A1SMN1; SMN2MEN1
SCHEMBL28701196 0.89 AKR1C3 (0.96) AKR1C3KMOKDM4EPARP10TNKS
SCHEMBL29546656 0.89 AKR1C3 (0.96) AKR1C3KMOKDM4EPARP10TNKS
SCHEMBL4320685 0.89 AKR1C3 (0.96) AKR1C3KMOKDM4EPARP10TNKS
SCHEMBL29436294 0.88 ALDH1A1 (0.66) AKR1C3KMOALDH1A1SMN1; SMN2MEN1
SCHEMBL8903435 0.88 ALDH1A1 (0.66) AKR1C3KMOALDH1A1SMN1; SMN2MEN1
SCHEMBL310329 0.88 ALDH1A1 (0.66) AKR1C3KMOALDH1A1SMN1; SMN2MEN1
SCHEMBL6380428 0.88 AKR1C3 (0.73) AKR1C3KMOKMT2AKDM4EPARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109734908-B Polyamide acid and preparation method thereof, polyimide and preparation method of polyimide film 武汉柔显科技股份有限公司 2021-01-12 CN claimed
US-8575335-B2 Method of preparing nitrogen-doped graphene and nitrogen-doped graphene prepared thereby UNIST ACADEMY-INDUSTRY RESEARCH CORPORATION (KR) 2013-11-05 US claimed
US-20120149897-A1 METHOD OF PREPARING NITROGEN-DOPED GRAPHENE AND NITROGEN-DOPED GRAPHENE PREPARED THEREBY UNIST (ULSAN NATIONAL INSTITUTE OF SCIENCE AND TECHNOLOGY) (KR) 2012-06-14 US claimed
CN-109734908-B Polyamide acid and preparation method thereof, polyimide and preparation method of polyimide film 武汉柔显科技股份有限公司 2021-01-12 CN disclosed
CN-109734908-B Polyamide acid and preparation method thereof, polyimide and preparation method of polyimide film 武汉柔显科技股份有限公司 2021-01-12 CN disclosed
US-20140329866-A1 OMEGA-CARBOXYARL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS BAYER HEALTHCARE LLC (US) 2014-11-06 US disclosed
US-20140329866-A1 OMEGA-CARBOXYARL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS BAYER HEALTHCARE LLC (US) 2014-11-06 US disclosed
US-20140329866-A1 OMEGA-CARBOXYARL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS BAYER HEALTHCARE LLC (US) 2014-11-06 US disclosed
US-8841330-B2 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC (US) 2014-09-23 US disclosed
US-8841330-B2 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC (US) 2014-09-23 US disclosed
US-8841330-B2 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC (US) 2014-09-23 US disclosed
US-20010034447-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-10-25 US disclosed
EP-1140840-A1 -G(V)-CARBOXYARYL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS Bayer Corporation (US) 2001-10-10 EP disclosed
US-20010027202-A1 Omega-carboxyaryl substituted disphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-10-04 US disclosed
US-20010016659-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-08-23 US disclosed
US-20010011135-A1 Omega-carboxyaryl subsituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-08-02 US disclosed
US-20010011136-A1 omega-carboxyyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-08-02 US disclosed
EP-1111442-A1 TREATING AGENT FOR LIQUID CRYSTAL ALIGNMENT LAYER AND LIQUID CRYSTAL DEVICE USING THE SAME, AND METHOD FOR ALIGNMENT OF LIQUID CRYSTAL Nissan Chemical Industries, Ltd. (JP) 2001-06-27 EP disclosed
WO-2000041698-A1 φ-CARBOXY ARYL SUBSTITUTED DIPHENYL UREAS AS p38 KINASE INHIBITORS BAYER CORPORATION (US) 2000-07-20 WO disclosed
WO-2000042012-A1 φ-CARBOXYARYL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS BAYER CORPORATION (US) 2000-07-20 WO 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 (6 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-20010011135-A1 Omega-carboxyaryl subsituted diphenyl ureas as raf kinase inhibitors BRAF, RAF1, ARAF AKR1C3 1174/4885KMO 2324/4885ALDH1A1 1431/4885
US-20010011136-A1 omega-carboxyyaryl substituted diphenyl ureas as raf kinase inhibitors BRAF, ARAF, RAF1 AKR1C3 1500/4885KMO 2341/4885ALDH1A1 1887/4885
US-20010034447-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BRAF, RAF1, ARAF AKR1C3 1257/4885KMO 2133/4885ALDH1A1 1392/4885
US-20010016659-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BRAF, RAF1, ARAF AKR1C3 1257/4885KMO 2133/4885ALDH1A1 1392/4885
US-20140329866-A1 OMEGA-CARBOXYARL SUBSTITUTED DIPHENYL UREAS AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF AKR1C3 852/4885KMO 2818/4885ALDH1A1 1800/4885
US-20010027202-A1 Omega-carboxyaryl substituted disphenyl ureas as raf kinase inhibitors BRAF, NRAS, ARAF AKR1C3 1603/4885KMO 2528/4885ALDH1A1 1474/4885

“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.