SCHEMBL27844968

SCHEMBL27844968

Cc1nc(Cc2cc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)ccc2C)nc(N2CCN(Cc3ccncc3)CC2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 1/20 0.45
▸ BRAF P15056 6/20 0.43
▸ BLM P54132 1/20 0.43
▸ MAPT P10636 3/20 0.42
▸ LMNA P02545 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ KDR P35968 4/20 0.42
▸ MAPK14 Q16539 1/20 0.42
▸ FLT1 P17948 4/20 0.41
▸ TP53 P04637 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ RAD52 P43351 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ RET P07949 1/20 0.41
▸ HIF1A Q16665 1/20 0.40
▸ EPAS1 Q99814 1/20 0.40
▸ CCNC P24863 1/20 0.40
▸ CDK8 P49336 1/20 0.40

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
SCHEMBL27862533 0.93 FAAH (0.46) BRAFMAPTLMNAALDH1A1GAA
SCHEMBL28793758 0.89 BRAF (0.45) SRCBRAFMAPTLMNAALDH1A1
SCHEMBL27862281 0.89 BRAF (0.45) BRAFMAPTLMNAALDH1A1GAA
SCHEMBL27844944 0.88 ABL1 (0.50) SRCBRAFMAPTLMNAALDH1A1
SCHEMBL27844969 0.87 BRAF (0.45) BRAFMAPTLMNAALDH1A1GAA
SCHEMBL27844948 0.87 BRAF (0.44) BRAFMAPTLMNAALDH1A1GAA
SCHEMBL28796270 0.87 BRAF (0.46) BRAFKDRMAPK14CCNCCDK8
SCHEMBL14146761 0.86 BRAF (0.58) BRAFKDRMAPK14
SCHEMBL27844960 0.86 CCR2 (0.46) BRAFMAPTLMNAALDH1A1GAA
SCHEMBL27844954 0.86 BRAF (0.54) SRCBRAFBLMMAPTLMNA

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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