SCHEMBL16760435

SCHEMBL16760435

COc1cc2c(Nc3c(F)ccc(O)c3C)ncnc2cc1OCCCCl

nearest known ligand 0.86

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RET P07949 20/20 0.86
KIF5B P33176 9/20 0.86
KDR P35968 1/20 0.83

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
SCHEMBL16760427 0.96 RET (0.84) RETKIF5BKDR
Hydrochloric Acid SCHEMBL16760398 0.95 RET (0.82) RETKIF5BKDR
SCHEMBL16760387 0.92 RET (1.00) RETKIF5BKDR
SCHEMBL16760548 0.92 RET (1.00) RETKIF5BKDR
SCHEMBL16760389 0.91 RET (1.00) RETKIF5BKDR
SCHEMBL16760447 0.91 RET (1.00) RETKIF5BKDR
SCHEMBL16760481 0.91 RET (1.00) RETKIF5BKDR
SCHEMBL29571310 0.91 RET (1.00) RETKIF5BKDR
SCHEMBL20399516 0.91 RET (1.00) RETKIF5BKDR
SCHEMBL16760506 0.91 RET (1.00) 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 disclosed
WO-2015079251-A1 QUINAZOLINE COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2015-06-04 WO disclosed