SCHEMBL20725660

SCHEMBL20725660

CCC[S+]([O-])Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRAF P15056 18/20 0.46
KDR P35968 2/20 0.43

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
SCHEMBL20725637 0.82 BRAF (0.47) BRAFKDR
SCHEMBL14979966 0.82 KDR (0.49) BRAFKDR
SCHEMBL14979829 0.82 BRAF (0.67) BRAF
SCHEMBL14979837 0.77 BRAF (0.45) BRAFKDR
SCHEMBL19233196 0.76 BRAF (0.58) BRAFKDR
SCHEMBL20725632 0.76 BRAF (0.55) BRAFKDR
SCHEMBL14964675 0.75 BRAF (0.69) BRAF
SCHEMBL9912754 0.75 BRAF (0.79) BRAF
SCHEMBL20725644 0.74 BRAF (0.56) BRAFKDR
SCHEMBL20577794 0.74 BRAF (0.57) BRAFKDR

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
EP-2780341-B1 KINASE MODULATING COMPOUNDS, COMPOSITIONS CONTAINING THE SAME AND USE THEREOF CHIA TAI TIANQING PHARMACEUTICAL GROUP CO LTD (CN) 2019-02-13 EP disclosed