SCHEMBL8974367

SCHEMBL8974367

CCCc1cccc2c(C=C(Cc3ccccc3)C(=O)O)cc(OC)c(O)c12

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
ERN1 O75460 1/20 0.38
PTGES O14684 2/20 0.38
PPARG P37231 1/20 0.38
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL8974365 1.00 ALOX5 (0.39) ALOX5CYP3A4CYP2C9ERN1PTGES
SCHEMBL9655150 0.93 CYP3A4 (0.41) ALOX5CYP3A4CYP2C9ERN1MEN1
SCHEMBL9652510 0.93 CYP3A4 (0.41) ALOX5CYP3A4CYP2C9ERN1MEN1
SCHEMBL9655265 0.90 PSEN1 (0.37) ALOX5ERN1PTGESPPARG
SCHEMBL8974534 0.90 PSEN1 (0.37) ALOX5ERN1PTGESPPARG
SCHEMBL8974675 0.90 PSEN1 (0.37) ALOX5ERN1PTGESPPARG
SCHEMBL8974350 0.84 ALOX5 (0.37) ALOX5ERN1MEN1KMT2A
SCHEMBL8974836 0.84 ALOX5 (0.37) ALOX5ERN1MEN1KMT2A
SCHEMBL8974364 0.84 ALOX5 (0.37) ALOX5ERN1MEN1KMT2A
SCHEMBL9655192 0.82 PSEN1 (0.36) ALOX5ERN1PPARGMEN1KMT2A

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-5527948-A SUBSTITUTED NAPHTHYL-ALKENOIC ACIDS FOR TREATING AUTOIMMUNE DISORDERS EISAI CORP. LTD. (JP) 1996-06-18 US disclosed