SCHEMBL17612919

SCHEMBL17612919

Cc1ccc(C(=O)Nc2cc(OC(F)(F)F)cc(N(C)CCN3CCCC3)c2)cc1-n1cc(-c2cn[nH]c2C)nn1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRAF P15056 1/20 0.54
GPR142 Q7Z601 2/20 0.52
ABL1 P00519 17/20 0.50
BCR P11274 17/20 0.50

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
SCHEMBL12398225 0.89 BRAF (0.54) BRAFGPR142ABL1BCR
SCHEMBL12398219 0.80 GPR142 (0.54) BRAFGPR142ABL1BCR
SCHEMBL12398160 0.79 BRAF (0.61) BRAFGPR142ABL1BCR
SCHEMBL17612980 0.79 BRAF (0.42) BRAFGPR142ABL1BCR
SCHEMBL12397171 0.76 GPR142 (0.54) GPR142ABL1BCR
SCHEMBL17612976 0.76 ABL1 (0.60) BRAFGPR142ABL1BCR
SCHEMBL17612982 0.75 ABL1 (0.56) BRAFGPR142ABL1BCR
SCHEMBL12398217 0.74 BRAF (0.55) BRAFGPR142ABL1BCR
SCHEMBL12398231 0.73 GPR142 (0.55) BRAFGPR142ABL1BCR
SCHEMBL12398230 0.73 GPR142 (0.53) BRAFGPR142ABL1BCR

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-2173734-B1 CHEMICAL COMPOUNDS BOEHRINGER INGELHEIM INT (DE) 2016-03-23 EP disclosed