SCHEMBL7948261

SCHEMBL7948261

COCOc1ccc(-c2c(S(C)(=O)=O)ccc(C(=O)O)c2C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
FFAR1 O14842 1/20 0.34
FYN P06241 1/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RARA P10276 1/20 0.34
RARB P10826 1/20 0.34
PTPN1 P18031 1/20 0.34
PTGER4 P35408 2/20 0.33
GAA P10253 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL7949524 0.87 ALDH1A1 (0.43) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL7947427 0.85 SMN1; SMN2 (0.47) SMN1; SMN2KDM4EALDH1A1POLBL3MBTL1
SCHEMBL7948251 0.80 LMNA (0.43)
SCHEMBL7949538 0.78 FYN (0.32) FYN
SCHEMBL7939947 0.76 MCL1 (0.39) MMP2MMP9
SCHEMBL7946291 0.73 SMN1; SMN2 (0.44) SMN1; SMN2KDM4EALDH1A1POLBGAA
SCHEMBL5470517 0.72 LMNA (0.34) KDM4EALDH1A1PTGER4NPSR1
SCHEMBL646150 0.71 PTGER4 (0.35) ALDH1A1PTGER4MAPTPRKAB2PRKAG1
Hydrochloric Acid SCHEMBL5473450 0.70 LMNA (0.33) KDM4EALDH1A1PTGER4NPSR1
SCHEMBL8138242 0.70 ALDH1A1 (0.42) ALDH1A1L3MBTL1MMP2MMP9

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 3 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