SCHEMBL8118643

SCHEMBL8118643

CCCNc1cnc2cc(OC)c(OC)cc2n1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 15/20 0.62
PDGFRA P16234 15/20 0.62
PGK1 P00558 4/20 0.50
EGFR P00533 1/20 0.50
INSR P06213 1/20 0.50
LCK P06239 1/20 0.50
ALDH1A1 P00352 1/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44

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
SCHEMBL3395817 0.84 PDGFRB (0.58) PDGFRBPDGFRAPGK1EGFRINSR
SCHEMBL24614203 0.77 PDGFRB (0.60) PDGFRBPDGFRAEGFRINSRLCK
SCHEMBL3908370 0.77 PDGFRB (1.00) PDGFRBPDGFRAPGK1EGFRLCK
SCHEMBL3389455 0.76 PDGFRB (0.55) PDGFRBPDGFRAPGK1EGFRINSR
SCHEMBL24894766 0.76 PDGFRB (0.59) PDGFRBPDGFRAPGK1EGFRINSR
SCHEMBL3884081 0.74 PDGFRB (0.47) PDGFRBPDGFRAPGK1EGFRINSR
SCHEMBL30223495 0.73 KDM4E (0.70) PDGFRBPDGFRAEGFRLCKALDH1A1
SCHEMBL29338738 0.72 PDGFRB (0.71) PDGFRBPDGFRAPGK1EGFRINSR
SCHEMBL3908347 0.72 PDGFRB (0.75) PDGFRBPDGFRAPGK1EGFRINSR
SCHEMBL12844007 0.71 ALDH1A1 (0.50) PDGFRBPDGFRAPGK1EGFRINSR

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-1001946-A4 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR p56?1ck TYROSINE KINASES RHONE POULENC RORER PHARMA (US) 2000-07-26 EP disclosed
EP-1001946-A1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR p56?1ck TYROSINE KINASES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 2000-05-24 EP disclosed
WO-1998054157-A1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR p561ck TYROSINE KINASES RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-12-03 WO disclosed