SCHEMBL8401367

SCHEMBL8401367

Cc1ccc(/C=C(\C#N)c2ccc(O)c(O)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.58
ERBB2 P04626 3/20 0.58
ESR1 P03372 2/20 0.56
ESR2 Q92731 2/20 0.56
MEN1 O00255 3/20 0.50
BLM P54132 3/20 0.50
KMT2A Q03164 3/20 0.50
POLB P06746 2/20 0.50
RAB9A P51151 2/20 0.50
NSD2 O96028 1/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
CYP1A2 P05177 3/20 0.49
CYP3A4 P08684 3/20 0.49
HIF1A Q16665 3/20 0.49
ALDH1A1 P00352 3/20 0.49
MAPT P10636 3/20 0.49
MAPK1 P28482 3/20 0.49

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
SCHEMBL8401369 1.00 EGFR (0.58) EGFRERBB2ESR1ESR2MEN1
SCHEMBL8397484 0.87 EGFR (0.62) EGFRERBB2ESR1ESR2MEN1
SCHEMBL30137200 0.85 ESR1 (0.69) EGFRERBB2ESR1ESR2MEN1
SCHEMBL14116372 0.85 ESR1 (0.69) EGFRERBB2ESR1ESR2MEN1
SCHEMBL823204 0.85 ESR1 (0.69) EGFRERBB2ESR1ESR2MEN1
SCHEMBL246918 0.85 ESR1 (0.69) EGFRERBB2ESR1ESR2MEN1
SCHEMBL13615366 0.85 ESR1 (0.69) EGFRERBB2ESR1ESR2MEN1
SCHEMBL8398968 0.84 ESR1 (0.56) EGFRERBB2ESR1ESR2MEN1
SCHEMBL8400487 0.84 ESR1 (0.56) EGFRERBB2ESR1ESR2MEN1
SCHEMBL9241983 0.84 ESR1 (0.56) EGFRERBB2ESR1ESR2MEN1

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-0640586-B1 STILBENE DERIVATIVE AND STILBENE ANALOG DERIVATIVE, AND USE THEREOF MORINAGA MILK INDUSTRY CO LTD (JP) 1999-06-09 EP disclosed
US-5589506-A ENZYME INHIBITORS FOR LIPOXYGENASE MORINAGA MILK INDUSTRY CO., LTD. (JP) 1996-12-31 US disclosed
EP-0640586-A1 STILBENE DERIVATIVE AND STILBENE ANALOG DERIVATIVE, AND USE THEREOF MORINAGA MILK INDUSTRY CO., LTD. (JP) 1995-03-01 EP disclosed