SCHEMBL8401348

SCHEMBL8401348

N#CC(=Cc1cccc(Cl)c1)c1ccc(O)c(O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF20A O95235 1/20 0.51
ALDH1A1 P00352 6/20 0.49
KMT2A Q03164 4/20 0.49
KDM4E B2RXH2 4/20 0.49
POLB P06746 2/20 0.49
PKM P14618 1/20 0.49
MAPT P10636 7/20 0.46
CYP1A2 P05177 5/20 0.46
HPGD P15428 5/20 0.46
EGFR P00533 5/20 0.46
CYP3A4 P08684 4/20 0.46
MAPK1 P28482 3/20 0.46
HIF1A Q16665 3/20 0.46
MEN1 O00255 3/20 0.46
BLM P54132 3/20 0.46
LMNA P02545 3/20 0.46
ERBB2 P04626 3/20 0.46
TP53 P04637 2/20 0.46
ALPL P05186 2/20 0.46
ALOX15 P16050 2/20 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
SCHEMBL8401347 1.00 KIF20A (0.51) KIF20AALDH1A1KMT2AKDM4EPOLB
SCHEMBL13485336 0.88 KIF20A (0.58) KIF20AALDH1A1KMT2AKDM4EPOLB
SCHEMBL8519245 0.85 ESR1 (0.63) KIF20AALDH1A1KMT2AKDM4EPOLB
SCHEMBL364137 0.85 MAPT (0.58) KIF20AALDH1A1KMT2AKDM4EPOLB
SCHEMBL364138 0.85 MAPT (0.58) KIF20AALDH1A1KMT2AKDM4EPOLB
SCHEMBL623482 0.84 ALDH1A1 (0.53) KIF20AALDH1A1KMT2AKDM4EPOLB
SCHEMBL623481 0.84 ALDH1A1 (0.53) KIF20AALDH1A1KMT2AKDM4EPOLB
SCHEMBL8400487 0.84 ESR1 (0.56) KIF20AALDH1A1KMT2AKDM4EPOLB
SCHEMBL8400486 0.84 ESR1 (0.56) KIF20AALDH1A1KMT2AKDM4EPOLB
SCHEMBL8397029 0.83 ESR1 (0.54) ALDH1A1KMT2AKDM4EPOLBPKM

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