SCHEMBL3755658

SCHEMBL3755658

[O]c1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.48
ALDH1A1 P00352 2/20 0.42
MAPT P10636 1/20 0.42
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
DAO P14920 1/20 0.41
MCL1 Q07820 3/20 0.40
CES2 O00748 2/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
HSD17B10 Q99714 1/20 0.39
AHR P35869 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38

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
SCHEMBL3760427 0.82 ALDH1A1 (0.45) PDE2AALDH1A1MEN1TSHRKMT2A
SCHEMBL29402881 0.78 TSHR (0.61) PDE2AALDH1A1MAPTMEN1TSHR
SCHEMBL980201 0.78 TSHR (0.61) PDE2AALDH1A1MAPTMEN1TSHR
Ammonia Solution, Strong SCHEMBL28020319 0.76 TSHR (0.58) PDE2AALDH1A1MAPTMEN1TSHR
SCHEMBL19785361 0.76 PDE2A (0.52) PDE2AALDH1A1MAPTTSHRAHR
SCHEMBL5537111 0.74 CES2 (0.55) ALDH1A1MEN1TSHRKMT2ADAO
SCHEMBL2839879 0.74 PDE2A (0.47) PDE2AALDH1A1MEN1TSHRKMT2A
SCHEMBL3028480 0.74 PDE2A (0.42) PDE2AALDH1A1MAPTMEN1KMT2A
SCHEMBL3822269 0.74 PDE2A (0.50) PDE2AALDH1A1MAPTMEN1TSHR
SCHEMBL3789260 0.74 PDE2A (0.56) PDE2AALDH1A1MAPTMEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113979887-A Synthetic method of aromatic amine carboxylic acid derivative 北京亦农生物科技有限公司 2022-01-28 CN claimed
US-9061967-B2 Substituted diphenylamine compounds, preparation method and use thereof SHENYANG RESEARCH INSTITUTE OF CHEMICAL INDUSTRY CO., LTD. (CN) 2015-06-23 US claimed
EP-2826474-A1 USE OF SUBSTITUTED DIPHENYLAMINE COMPOUNDS IN PREPARING ANTI-TUMOUR DRUGS Sinochem Corporation (CN) 2015-01-21 EP claimed
US-20150011628-A1 SUBSTITUTE DIPHENYLAMINE COMPOUNDS USE THEREOF AS ANTITUMOR AGENTS SHENYANG RESEARCH INSTITUTE OF CHEMICAL INDUSTRY CO., LTD. (CN) 2015-01-08 US claimed
EP-2551258-A1 SUBSTITUTED DIPHENYLAMINE COMPOUNDS, PREPARATION METHOD AND USE THEREOF Sinochem Corporation (CN) 2013-01-30 EP claimed
US-20120309844-A1 Substituted Diphenylamine Compounds, Preparation Method and Use Thereof SHENYANG RESEARCH INSTITUTE OF CHEMICAL INDUSTRY CO., LTD. (CN) 2012-12-06 US claimed
CN-1363548-A Bietherifying process for synthesizing oxyfluorfen LANXI AGRICULTURLA CHEMICAL FA (NC) 2002-08-14 CN claimed
EP-1148056-A1 Herbicidal benzoyloxy carboxylates and carboxamides Dow AgroSciences LLC (US) 2001-10-24 EP claimed
US-6251829-B1 PREEMERGENT AND POSTEMERGENT HERBICIDES ROHM AND HAAS COMPANY 2001-06-26 US claimed
CN-1253593-A Expression of herbicide binding polypeptides in plants to confer herbicide tolerance BASF AG (DE) 2000-05-17 CN claimed
US-5155135-A Insecticides, miticides SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ, B.V. (NL) 1992-10-13 US claimed
CN-1043702-A Benzamide compounds, its preparation method and as the application of sterilant SHELL INT RESEARCH (NL) 1990-07-11 CN claimed
EP-0375069-A1 Benzamide compounds, their preparation and their use as pesticides SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1990-06-27 EP claimed
EP-0261459-A2 N-benzothiazolyl amides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1988-03-30 EP claimed
EP-0103918-B1 PESTICIDAL BENZOYLUREA COMPOUNDS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-07-29 EP claimed
EP-0093976-B1 2,4-DIHALOGENBENZOYL UREAS AND THIOUREAS, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AG (DE) 1986-09-10 EP claimed
US-4517193-A INSECTICIDES, MITICIDES SHELL OIL COMPANY (US) 1985-05-14 US claimed
US-4497822-A Insecticidal N-benzoyl-N'-phenyl-N'-(R-thio)ureas SHELL OIL COMPANY (US) 1985-02-05 US claimed
US-4493730-A Phenoxypyridine useful as a herbicide ISHIHARA SANGYO KAISHA, LTD. (JP) 1985-01-15 US claimed
EP-0103918-A2 Pesticidal benzoylurea compounds SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1984-03-28 EP 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-20120309844-A1 Substituted Diphenylamine Compounds, Preparation Method and Use Thereof DDT, DPM1, CYP3A7 PDE2A 595/4885ALDH1A1 321/4885MAPT 3075/4885
US-20150011628-A1 SUBSTITUTE DIPHENYLAMINE COMPOUNDS USE THEREOF AS ANTITUMOR AGENTS MCL1, BRCA1, FLI1 PDE2A 3294/4885ALDH1A1 91/4885MAPT 2348/4885

“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.