SCHEMBL27844969

SCHEMBL27844969

Cc1nc(Cc2cc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)ccc2C)nc(N2CCN(CC#N)CC2)n1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 7/20 0.45
▸ KDR P35968 1/20 0.42
▸ MAPT P10636 5/20 0.42
▸ LMNA P02545 4/20 0.42
▸ TP53 P04637 2/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ GAA P10253 1/20 0.41
▸ TRPV1 Q8NER1 2/20 0.40
▸ HDAC6 Q9UBN7 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ MAPK14 Q16539 2/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ USP30 Q70CQ3 1/20 0.39
▸ CCNC P24863 1/20 0.39
▸ CDK8 P49336 1/20 0.39

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
SCHEMBL27862281 0.89 BRAF (0.45) BRAFKDRMAPTLMNATP53
SCHEMBL27862533 0.88 FAAH (0.46) BRAFKDRMAPTLMNATP53
SCHEMBL28796270 0.88 BRAF (0.46) BRAFKDRTRPV1MAPK14EPHX2
SCHEMBL27844968 0.87 SRC (0.45) BRAFKDRMAPTLMNATP53
SCHEMBL14146761 0.87 BRAF (0.58) BRAFKDRMAPK14EPHX2
SCHEMBL27844960 0.87 CCR2 (0.46) BRAFKDRMAPTLMNATP53
SCHEMBL27845008 0.85 BRAF (0.51) BRAFKDRMAPTLMNATP53
SCHEMBL28793758 0.85 BRAF (0.45) BRAFKDRMAPTLMNATP53
SCHEMBL27845100 0.85 BRAF (0.43) BRAFKDRMAPTLMNATP53
SCHEMBL27844948 0.85 BRAF (0.44) BRAFKDRMAPTLMNATP53

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
CN-102250065-A Substituted triazine phenyl urea derivatives and application thereof ZHEJIANG HISUN PHARM CO LTD 2011-11-23 — — CN disclosed
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