SCHEMBL16760484

SCHEMBL16760484

COc1cc2c(Nc3c(F)ccc(O)c3C)ncnc2cc1OCCN1CCCC1

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 0.90
KDR P35968 1/20 0.74

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
SCHEMBL16760496 0.99 RET (1.00) RETKIF5BKDR
SCHEMBL16760559 0.99 RET (1.00) RETKIF5BKDR
SCHEMBL16760355 0.98 RET (0.97) RETKIF5BKDR
SCHEMBL16760444 0.96 RET (1.00) RETKIF5B
SCHEMBL16760449 0.95 RET (1.00) RETKIF5B
SCHEMBL16760386 0.95 RET (1.00) RETKIF5B
SCHEMBL16760425 0.94 RET (0.94) RETKIF5BKDR
SCHEMBL16760439 0.94 RET (1.00) RETKIF5BKDR
SCHEMBL16760371 0.94 RET (0.97) RETKIF5B
SCHEMBL16760382 0.93 RET (0.94) RETKIF5B

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