SCHEMBL6694462

SCHEMBL6694462

CCc1c(OC(C)=O)ccc(C(=O)O)c1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 2/20 0.49
KDM4E B2RXH2 7/20 0.47
HSD17B10 Q99714 4/20 0.47
ALDH1A1 P00352 4/20 0.47
HPGD P15428 3/20 0.47
TSHR P16473 3/20 0.47
PTGS2 P35354 3/20 0.47
PTGS1 P23219 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
ESR1 P03372 1/20 0.47
ITGB3 P05106 1/20 0.47
ITGA2B P08514 1/20 0.47
HMGB1 P09429 1/20 0.47
GGT1 P19440 1/20 0.47
BLM P54132 1/20 0.47
NAPRT Q6XQN6 1/20 0.47
USP2 O75604 1/20 0.47
CYP2C19 P33261 1/20 0.47
MAPK1 P28482 2/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL6692045 0.84 TSHR (0.44) CFDKDM4EHSD17B10ALDH1A1TSHR
SCHEMBL28680212 0.83 CFD (0.50) CFDKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL6698411 0.82 CFD (0.56) CFDKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL10430941 0.81 CFD (0.49) CFDKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL6971645 0.81 TSHR (0.45) CFDKDM4EALDH1A1TSHRPTGS1
SCHEMBL6975036 0.81 PIM1 (0.45) CFDKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL16666925 0.80 CFD (0.48) CFDKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL29058037 0.79 KDM4E (0.47) CFDKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL30587342 0.79 KDM4E (0.47) CFDKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL5738308 0.77 MRGPRX4 (0.37) KDM4EHSD17B10ALDH1A1HPGDUSP2

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-0950669-B1 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM & HAAS (US) 2004-09-08 EP disclosed
US-6149977-A CONTACTING THE OXIDATIVE POLYMER WITH A CATALYTIC AMOUNT OF AN OXIDIZING ENZYME, SUCH AS HORSERADISH PEROXIDASE. ROHM AND HAAS COMPANY (US) 2000-11-21 US disclosed
EP-0950669-A2 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM AND HAAS COMPANY (US) 1999-10-20 EP disclosed