SCHEMBL16760422

SCHEMBL16760422

CCN(CC)CCCOc1cc2ncnc(Nc3c(F)ccc(O)c3C)c2cc1OC

nearest known ligand 0.84

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RET P07949 19/20 0.84
KIF5B P33176 9/20 0.84
KDR P35968 1/20 0.75
EGFR P00533 1/20 0.68

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
SCHEMBL16760540 0.96 RET (0.83) RETKIF5BKDREGFR
SCHEMBL16760516 0.95 RET (0.84) RETKIF5BKDR
SCHEMBL16760521 0.91 RET (1.00) RETKIF5BKDR
SCHEMBL16760364 0.90 RET (0.85) RETKIF5BKDR
SCHEMBL16760362 0.90 RET (0.83) RETKIF5BKDR
SCHEMBL16760400 0.88 RET (1.00) RETKIF5BKDR
SCHEMBL16760435 0.88 RET (0.86) RETKIF5BKDR
SCHEMBL16760548 0.88 RET (1.00) RETKIF5BKDR
SCHEMBL16760387 0.88 RET (1.00) RETKIF5BKDR
SCHEMBL16760339 0.88 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 1 patent. 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