SCHEMBL8898528

SCHEMBL8898528

CCOC(C)Oc1ccc(C=CC(O)=Cc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 1/20 0.44
LTB4R2 Q9NPC1 1/20 0.44
RELA Q04206 1/20 0.44
NPC1 O15118 2/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
EGFR P00533 1/20 0.40
PPARA Q07869 3/20 0.39
PPARG P37231 2/20 0.39
MTOR P42345 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 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
SCHEMBL8897477 0.86 TRPA1 (0.45) LTB4RLTB4R2RELANPC1MAOB
SCHEMBL27224303 0.86 RELA (0.59) RELANPC1MAPTRAB9AKMT2A
SCHEMBL3842067 0.85 LTB4R (0.41) LTB4RLTB4R2RELANPC1MAOA
SCHEMBL7199294 0.85 LTB4R (0.41) LTB4RLTB4R2RELANPC1MAOA
SCHEMBL8965288 0.82 LTB4R (0.39) LTB4RLTB4R2RELANPC1MAOA
SCHEMBL8898532 0.78 RELA (0.43) LTB4RLTB4R2RELANPC1MAPT
SCHEMBL4965564 0.76 LTB4R (0.39) LTB4RLTB4R2NPC1MAOAMAOB
SCHEMBL3838358 0.75 CA12 (0.43) MAOAMAOBMAPTRAB9AKMT2A
SCHEMBL3843992 0.75 TAS1R3 (0.35) LTB4RLTB4R2NPC1MAPTRAB9A
SCHEMBL6280731 0.75 RELA (0.41) RELAMAOBBCHEPTGS2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5670299-A COATING A PHOTORESISTS POLYMER ON A SUBSTRATE, DEVELOPMENT AND HEAT TREATMENT WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1997-09-23 US disclosed