SCHEMBL28793758

SCHEMBL28793758

Cc1nc(Cc2cc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)ccc2C)nc(N2CCN(Cc3cccs3)CC2)n1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 5/20 0.45
▸ LMNA P02545 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ CSF1R P07333 3/20 0.40
▸ KIT P10721 3/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ KDR P35968 2/20 0.40
▸ SRC P12931 2/20 0.40
▸ TRPV1 Q8NER1 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ EPHA2 P29317 1/20 0.39
▸ MAPK14 Q16539 2/20 0.39
▸ ABL1 P00519 2/20 0.39
▸ PDGFRB P09619 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
SCHEMBL27862533 0.90 FAAH (0.46) BRAFLMNAMAPTALDH1A1GAA
SCHEMBL27844968 0.89 SRC (0.45) BRAFLMNAMAPTALDH1A1GAA
SCHEMBL27844948 0.88 BRAF (0.44) BRAFLMNAMAPTALDH1A1GAA
SCHEMBL27862281 0.87 BRAF (0.45) BRAFLMNAMAPTALDH1A1GAA
SCHEMBL27862199 0.86 BRAF (0.51) BRAFLMNAMAPTALDH1A1GAA
SCHEMBL14146761 0.86 BRAF (0.58) BRAFCA9KDRMAPK14
SCHEMBL27844969 0.85 BRAF (0.45) BRAFLMNAMAPTALDH1A1GAA
SCHEMBL28796270 0.85 BRAF (0.46) BRAFCA9KDRTRPV1MAPK14
SCHEMBL27844960 0.84 CCR2 (0.46) BRAFLMNAMAPTALDH1A1GAA
SCHEMBL27845100 0.84 BRAF (0.43) BRAFLMNAMAPTALDH1A1GAA

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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