SCHEMBL434576

SCHEMBL434576

O=C(c1ccccc1)c1cn[nH]c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HTT P42858 2/20 0.49
ATM Q13315 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
SRD5A2 P31213 1/20 0.48
AKT1 P31749 1/20 0.45
AKT2 P31751 1/20 0.45
ALOX15 P16050 1/20 0.44
ELANE P08246 1/20 0.44
ROCK2 O75116 1/20 0.42
MAPT P10636 2/20 0.42
RAB9A P51151 2/20 0.42
LMNA P02545 1/20 0.42
MAPK13 O15264 1/20 0.42
MAPK12 P53778 1/20 0.42
MAPK11 Q15759 1/20 0.42
MAPK14 Q16539 1/20 0.42

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
SCHEMBL4810366 0.81 LMNA (0.53) ALDH1A1MEN1KMT2AHTTSRD5A2
SCHEMBL1784996 0.79 PBRM1 (0.59) ALDH1A1MEN1KMT2AHTTATM
SCHEMBL1179681 0.77 KMT2A (0.61) ALDH1A1MEN1KMT2AHTTL3MBTL1
SCHEMBL18097664 0.77 SRD5A2 (0.56) ALDH1A1HTTSRD5A2ROCK2RAB9A
SCHEMBL29864 0.76
SCHEMBL930016 0.76 ALDH1A1 (0.43) ALDH1A1HTTAKT1AKT2ROCK2
Biphenyl SCHEMBL21043748 0.76 AKT2 (0.55) ALDH1A1TDP1L3MBTL1AKT1AKT2
SCHEMBL601922 0.76 ROCK1 (0.59) ALDH1A1HTTL3MBTL1ALOX15ROCK2
Benzophenone SCHEMBL6061130 0.75 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AATMTDP1
Benzophenone SCHEMBL28491203 0.75 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AATMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107674025-B 4-benzoyl pyrazole compound and preparation method and application thereof 青岛清原化合物有限公司 2019-12-31 CN claimed
CN-107674025-A A kind of 4 benzoylpyrazole class compounds and its preparation method and application 青岛清原化合物有限公司 2018-02-09 CN claimed
CN-103980202-B 4-benzoyl pyrazole compound with herbicidal activity 青岛清原化合物有限公司 2017-01-18 CN claimed
CN-103980202-A 4-benzoyl pyrazole compound with herbicidal activity QINGDAO QINGYUAN CHEMICAL COMPOUND CO LTD 2014-08-13 CN claimed
EP-1001939-B1 HETEROCYCLIC SUBSTITUTED 4-BENZOYL-PYRAZOLE AS HERBICIDES BASF SE (DE) 2009-01-07 EP claimed
US-20070149407-A1 Aqueous suspension concentrates BAYER CROPSCIENCE GMBH (DE) 2007-06-28 US claimed
WO-2007059870-A2 AQUEOUS SUSPENSION CONCENTRATES OF 4-BENZOYLPYRAZOLE HERBICIDES BAYER CROPSCIENCE AG (DE) 2007-05-31 WO claimed
EP-1003736-B1 SUBSTITUTED 4-BENZOYL-PYRAZOLES BASF AG (DE) 2006-04-12 EP claimed
EP-0960100-B1 SUBSTITUTED 4-BENZOYL-PYRAZOLES BASF AG (DE) 2003-07-09 EP claimed
CN-1106385-C Substituted 4-benzoyl-pyrazoles BASF AG (DE) 2003-04-23 CN claimed
EP-1001939-A1 HETEROCYCLIC SUBSTITUTED 4-BENZOYL-PYRAZOLE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-05-24 EP claimed
EP-0984962-A1 SUBSTITUTED 4-BENZOYL-PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 2000-03-15 EP claimed
CN-1247532-A Substituted 4-benzoylpyrazoles BASF AG (DE) 2000-03-15 CN claimed
US-6028035-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-02-22 US claimed
EP-0960100-A1 SUBSTITUTED 4-BENZOYL-PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 1999-12-01 EP claimed
WO-1999010328-A1 HETEROCYCLIC SUBSTITUTED 4-BENZOYL-PYRAZOLE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1999-03-04 WO claimed
WO-1999007697-A1 SUBSTITUTED 4-BENZOYL-PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 1999-02-18 WO claimed
WO-1998050379-A1 SUBSTITUTED 4-BENZOYL-PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 1998-11-12 WO claimed
WO-1998029392-A1 SUBSTITUTED 4-BENZOYL-PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 1998-07-09 WO claimed
US-4070536-A Process for the preparation of 4-benzoylpyrazole derivatives SANKYO COMPANY LIMITED (JA) 1978-01-24 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 (1 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-20070149407-A1 Aqueous suspension concentrates ASH2L, FLOT1, SMARCD2 ALDH1A1 2962/4885MEN1 4431/4885KMT2A 1253/4885

“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.