SCHEMBL7204107

SCHEMBL7204107

CCN(/C(C#N)=C/C=C/c1cc(OC)c(O)c(OC)c1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.42
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
ATM Q13315 1/20 0.42
ALOX5 P09917 7/20 0.42
EGFR P00533 2/20 0.40
ERBB2 P04626 1/20 0.40
KDM4E B2RXH2 2/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
TSHR P16473 1/20 0.38
LMNA P02545 2/20 0.38
TUBB1 Q9H4B7 1/20 0.38
ALOX12 P18054 1/20 0.38
ABL1 P00519 1/20 0.37
BCR P11274 1/20 0.37
ALDH1A1 P00352 2/20 0.37
USP2 O75604 2/20 0.37

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
SCHEMBL7166657 0.91 TRPM8 (0.42) MAPTKMT2AMEN1ATMALOX5
SCHEMBL4483001 0.85 KMT2A (0.46) MAPTKMT2AMEN1ALOX5EGFR
SCHEMBL7156759 0.85 ADORA2A (0.39) MAPTKMT2AMEN1ATMEGFR
SCHEMBL7205277 0.83 SLC16A3 (0.40) MAPTKMT2AMEN1ATMEGFR
SCHEMBL4486790 0.79 KMT2A (0.45) MAPTKMT2AMEN1ALOX5EGFR
SCHEMBL4487336 0.74 ALDH1A1 (0.47) MAPTKMT2AMEN1KDM4EPKM
SCHEMBL4483009 0.72 EGFR (0.58) MAPTKMT2AMEN1ATMEGFR
SCHEMBL4483014 0.72 EGFR (0.58) MAPTKMT2AMEN1ATMEGFR
SCHEMBL4418574 0.71 EGFR (0.49) MAPTKMT2AMEN1ATMALOX5
SCHEMBL14381045 0.71 ABL1 (0.50) MAPTKMT2AMEN1ATMALOX5

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
JP-2003531133-A 2003-10-21 JP claimed
EP-1272457-A2 COMPOUNDS FOR MODULATING CELL PROLIFERATION HSC Research and Development Limited Partnership (CA) 2003-01-08 EP claimed
WO-2001079158-A2 COMPOUNDS FOR MODULATING CELL PROLIFERATION HSC RESEARCH AND DEVELOPMENT LIMITED PARTNERSHIP (CA) 2001-10-25 WO claimed