SCHEMBL7057161

SCHEMBL7057161

CCN(CC)CCOc1cc(Nc2nccc(Cl)n2)ccc1OC

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.47
EGFR P00533 4/20 0.47
ABL1 P00519 1/20 0.45
BCR P11274 1/20 0.45
ESR1 P03372 1/20 0.45
IGF1R P08069 4/20 0.44
AGER Q15109 2/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
MCHR1 Q99705 1/20 0.42
EPHB4 P54760 1/20 0.42

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
SCHEMBL7056569 0.87 ABL1 (0.47) KDREGFRABL1BCRIGF1R
SCHEMBL1131631 0.83 IGF1R (0.58) KDREGFRIGF1RMEN1LMNA
SCHEMBL30367076 0.83 EHMT2 (0.50) KDREGFRABL1BCRIGF1R
SCHEMBL19476910 0.83 EHMT2 (0.50) KDREGFRABL1BCRIGF1R
SCHEMBL7052367 0.80 AGER (0.66) KDREGFRABL1BCRESR1
SCHEMBL12156502 0.75 MCHR1 (0.53) KDREGFRABL1BCRESR1
SCHEMBL19461921 0.74 EHMT2 (0.54) KDREGFRIGF1RMEN1LMNA
SCHEMBL19477274 0.74 EHMT2 (0.52) KDREGFRABL1BCRIGF1R
SCHEMBL1131578 0.73 CDK2 (0.68) KDREGFRIGF1REPHB4
SCHEMBL31378722 0.73 IGF1R (0.68) KDREGFRIGF1RMCHR1EPHB4

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
WO-2003026666-A1 2-PHENYLAMINO-4- (5-PYRAZOLYLAMINO)-PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS, IN PARTICULAR, AS SRC KINASE INHIBITORS BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-03 WO disclosed