SCHEMBL1418998

SCHEMBL1418998

CCOC(=O)CN1CCC(Oc2cc3ncnc(Nc4cccc(Br)c4)c3cc2[N+](=O)[O-])CC1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 2/20 0.64
▸ EGFR P00533 17/20 0.59
▸ ERBB2 P04626 2/20 0.52
▸ ERBB4 Q15303 1/20 0.49

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
SCHEMBL1418205 0.91 FBP1 (0.66) FBP1EGFRERBB2ERBB4
SCHEMBL1418159 0.90 FBP1 (0.64) FBP1EGFRERBB2ERBB4
SCHEMBL1417778 0.89 FBP1 (0.63) FBP1EGFRERBB2ERBB4
SCHEMBL1417772 0.88 EGFR (0.58) FBP1EGFRERBB2ERBB4
SCHEMBL1417808 0.88 FBP1 (0.68) FBP1EGFRERBB2ERBB4
SCHEMBL1417908 0.87 FBP1 (0.67) FBP1EGFRERBB2
SCHEMBL3583792 0.86 EGFR (0.70) FBP1EGFRERBB2ERBB4
SCHEMBL1418015 0.84 EGFR (0.64) EGFRERBB2ERBB4
SCHEMBL1418660 0.83 EGFR (0.61) FBP1EGFRERBB2
SCHEMBL4236019 0.82 EGFR (0.56) FBP1EGFRERBB2ERBB4

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-2298746-A1 4-amino- quinazoline and quinoline derivatives having an inhibitory effect on signal transduction mediated by tyrosine kinases Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2011-03-23 — — EP disclosed
EP-1157011-A1 4-AMINO- QUINAZOLINE AND QUINOLINE DERIVATIVES HAVING AN INHIBITORY EFFECT ON SIGNAL TRANSDUCTION MEDIATED BY TYROSINE KINASES Boehringer Ingelheim Pharma KG (DE) 2001-11-28 — — EP disclosed
WO-2000051991-A1 4-AMINO-QUINAZOLINE AND QUINOLINE DERIVATIVES HAVING AN INHIBITORY EFFECT ON SIGNAL TRANsSDUCTION MEDIATED BY TYROSINE KINASES BOEHRINGER INGELHEIM PHARMA KG (DE) 2000-09-08 — — WO disclosed
Send feedback