SCHEMBL7947427

SCHEMBL7947427

COc1ccc(-c2c(S(C)(=O)=O)ccc(C(=O)O)c2C)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
GAA P10253 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
GPR35 Q9HC97 1/20 0.44
POLB P06746 3/20 0.43
HPGD P15428 2/20 0.43
MAPK1 P28482 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL7946291 0.86 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1KDM4EGAARXFP1
SCHEMBL7948261 0.85 SMN1; SMN2 (0.34) SMN1; SMN2ALDH1A1KDM4EGAARXFP1
SCHEMBL7948251 0.85 LMNA (0.43) LMNA
SCHEMBL7949524 0.85 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1KDM4EPOLBHPGD
SCHEMBL7939947 0.82 MCL1 (0.39) AKR1C3
SCHEMBL989189 0.79 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1KDM4EGAARXFP1
SCHEMBL1358599 0.77 TDP1 (0.44) SMN1; SMN2ALDH1A1KDM4EPOLBMAPK1
SCHEMBL30249709 0.77 ALDH1A1 (0.41) ALDH1A1HPGDCA1CA2LMNA
SCHEMBL7948257 0.76 MAPK1 (0.36) SMN1; SMN2ALDH1A1KDM4EMAPK1LMNA
SCHEMBL8489045 0.75 AKR1C3 (0.50) SMN1; SMN2ALDH1A1KDM4EGAAPOLB

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265606-B1 TO CONTROL A BROAD SPECTRUM OF UNDESIRABLE VEGETATION, ARE SELECTIVE TO MAJOR CROPS, HAVE DESIRABLE ENVIRONMENTAL PROFILES, DOW AGROSCIENCES LLC 2001-07-24 US claimed
EP-0914317-A2 1-ALKYL-4-BENZOYL-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 1999-05-12 EP claimed
WO-1998052926-A2 1-ALKYL-4-BENZOYL-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 1998-11-26 WO claimed
US-6265606-B1 TO CONTROL A BROAD SPECTRUM OF UNDESIRABLE VEGETATION, ARE SELECTIVE TO MAJOR CROPS, HAVE DESIRABLE ENVIRONMENTAL PROFILES, DOW AGROSCIENCES LLC 2001-07-24 US disclosed
US-6010981-A 1-alkyl-4-benzoyl-5-hydroxypyrazole compounds and their use as herbicides DOW AGROSCIENCES LLC (US) 2000-01-04 US disclosed
EP-0914317-A2 1-ALKYL-4-BENZOYL-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 1999-05-12 EP disclosed
WO-1998052926-A2 1-ALKYL-4-BENZOYL-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 1998-11-26 WO disclosed