SCHEMBL7056569

SCHEMBL7056569

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

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.47
BCR P11274 1/20 0.47
MCHR1 Q99705 1/20 0.45
KDR P35968 11/20 0.43
EGFR P00533 3/20 0.43
IGF1R P08069 1/20 0.42
CDK4 P11802 2/20 0.40
CDC7 O00311 1/20 0.40
AURKA O14965 1/20 0.40
AURKB Q96GD4 1/20 0.40
CDK2 P24941 1/20 0.40
GSK3B P49841 1/20 0.40
BIRC5 O15392 1/20 0.40
CCND1 P24385 1/20 0.40
CCND2 P30279 1/20 0.40
CCND3 P30281 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40

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
SCHEMBL7057161 0.87 KDR (0.47) ABL1BCRMCHR1KDREGFR
SCHEMBL14648633 0.83 IGF1R (0.55) KDREGFRIGF1RCDK4CDC7
SCHEMBL19476910 0.81 EHMT2 (0.50) ABL1BCRKDREGFRIGF1R
SCHEMBL30367076 0.81 EHMT2 (0.50) ABL1BCRKDREGFRIGF1R
SCHEMBL7052995 0.80 AGER (0.60) ABL1BCREGFR
SCHEMBL12156502 0.75 MCHR1 (0.53) ABL1BCRMCHR1KDREGFR
SCHEMBL19477274 0.72 EHMT2 (0.52) ABL1BCRKDREGFRIGF1R
SCHEMBL19474426 0.71 IGF1R (0.43) KDREGFRIGF1RCDK4AURKA
SCHEMBL6610208 0.71 MCHR1 (0.63) ABL1BCRMCHR1KDR
SCHEMBL6811201 0.71 MCHR1 (0.58) MCHR1KDREGFRBIRC5BCHE

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