SCHEMBL7564366

SCHEMBL7564366

CCCCOC(=O)Nc1cccc(NC(=O)O)c1C

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.60
CYP1A2 P05177 4/20 0.60
CYP2C19 P33261 4/20 0.60
ALDH1A1 P00352 7/20 0.55
RAB9A P51151 8/20 0.53
HPGD P15428 7/20 0.53
LMNA P02545 3/20 0.53
NPC1 O15118 7/20 0.53
CYP2C9 P11712 2/20 0.53
NLRP3 Q96P20 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.50
KDM4E B2RXH2 2/20 0.50
CASP1 P29466 1/20 0.49
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49
MCL1 Q07820 1/20 0.49
TSHR P16473 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
NFKB1 P19838 1/20 0.46
STAT1 P42224 1/20 0.46

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
SCHEMBL3386794 0.95 SMN1; SMN2 (0.65) SMN1; SMN2CYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL7564388 0.91 LMNA (0.60) SMN1; SMN2CYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL1956240 0.88 NLRP3 (0.66) SMN1; SMN2CYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL7420206 0.87 SMN1; SMN2 (0.59) SMN1; SMN2CYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL7563374 0.86 ALDH1A1 (0.71) SMN1; SMN2CYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL6129365 0.85 CYP1A2 (0.60) SMN1; SMN2CYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL28969405 0.85 MAPK1 (0.59) SMN1; SMN2CYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL1952010 0.84 NLRP3 (0.64) SMN1; SMN2CYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL5086243 0.84 SMN1; SMN2 (0.53) SMN1; SMN2CYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL7790395 0.83 SMN1; SMN2 (0.65) SMN1; SMN2CYP1A2CYP2C19ALDH1A1RAB9A

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
EP-0855393-B1 BISBENZOTRIAZOLYLPHENOLS OTSUKA KAGAKU KK (JP) 2002-08-14 EP disclosed
US-5922882-A ULTRAVIOLET RADIATION ABSORBER; COPOLYMERIZATION COMPONENT OF BISBENZOTRIAZOLE COMPRISING A COPOLYCARBONATE, A COPOLYESTER, A COPOLYURETHANE AND A COPOLYURETHANEURA OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1999-07-13 US disclosed
EP-0855393-A1 BISBENZOTRIAZOLYLPHENOLS OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1998-07-29 EP disclosed