SCHEMBL16760481

SCHEMBL16760481

COCCOc1cc2ncnc(Nc3c(F)ccc(O)c3C)c2cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RET P07949 20/20 1.00
KIF5B P33176 10/20 1.00
KDR P35968 1/20 0.84

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
SCHEMBL16760447 1.00 RET (1.00) RETKIF5BKDR
SCHEMBL16760387 0.95 RET (1.00) RETKIF5BKDR
SCHEMBL16760368 0.93 RET (0.86) RETKIF5BKDR
SCHEMBL16760389 0.92 RET (1.00) RETKIF5BKDR
SCHEMBL20399516 0.92 RET (1.00) RETKIF5BKDR
SCHEMBL29571310 0.92 RET (1.00) RETKIF5BKDR
SCHEMBL16760435 0.91 RET (0.86) RETKIF5BKDR
SCHEMBL16760427 0.91 RET (0.84) RETKIF5BKDR
SCHEMBL16760548 0.91 RET (1.00) RETKIF5BKDR
SCHEMBL16760354 0.91 RET (0.84) RETKIF5BKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015079251-A1 QUINAZOLINE COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2015-06-04 WO claimed
WO-2015079251-A1 QUINAZOLINE COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2015-06-04 WO disclosed