SCHEMBL8081980

SCHEMBL8081980

Nc1ccc2ncnc(Nc3ccc4cc[nH]c4c3)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 18/20 1.00
RET P07949 1/20 0.66
ERBB2 P04626 3/20 0.55
RIPK2 O43353 1/20 0.54

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
SCHEMBL8093519 0.90 EGFR (1.00) EGFRERBB2
SCHEMBL7966781 0.86 EGFR (0.76) EGFRRETRIPK2
SCHEMBL8524535 0.81 EGFR (0.82) EGFRRETERBB2
SCHEMBL8976728 0.80 RET (1.00) EGFRRETRIPK2
SCHEMBL2103341 0.79 EGFR (0.82) EGFRERBB2
SCHEMBL15052504 0.79 BRAF (0.76) EGFRRET
SCHEMBL11953092 0.79 RET (0.67) EGFRRETERBB2RIPK2
SCHEMBL7978781 0.78 EGFR (0.78) EGFRRETERBB2
SCHEMBL7978783 0.78 EGFR (0.78) EGFRRETERBB2
SCHEMBL1733829 0.77 EGFR (0.76) EGFRRETERBB2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6153617-A Irreversible bicyclic inhibitors of tyrosine kinases WARNER-LAMBERT COMPANY (US) 2000-11-28 US claimed
WO-1999006396-A1 IRREVERSIBLE BICYCLIC INHIBITORS OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 1999-02-11 WO claimed
US-6153617-A Irreversible bicyclic inhibitors of tyrosine kinases WARNER-LAMBERT COMPANY (US) 2000-11-28 US disclosed
WO-1999006396-A1 IRREVERSIBLE BICYCLIC INHIBITORS OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 1999-02-11 WO disclosed