SCHEMBL27862196

SCHEMBL27862196

Cc1nc(CN2CCOCC2)nc(Nc2cc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)ccc2C)n1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 9/20 0.55
▸ MAPK14 Q16539 3/20 0.53
▸ RAF1 P04049 5/20 0.47
▸ THRB P10828 1/20 0.46
▸ KDR P35968 4/20 0.46
▸ EGFR P00533 2/20 0.46
▸ RET P07949 1/20 0.44
▸ TRPV1 Q8NER1 1/20 0.44
▸ FGFR1 P11362 1/20 0.44

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
SCHEMBL27862192 0.86 BRAF (0.54) BRAFMAPK14RAF1THRBKDR
SCHEMBL14146747 0.86 BRAF (0.62) BRAFMAPK14RAF1KDR
SCHEMBL14146776 0.81 BRAF (0.55) BRAFMAPK14KDRRETTRPV1
SCHEMBL14147194 0.81 BRAF (0.65) BRAFMAPK14KDRTRPV1
SCHEMBL27862284 0.80 BRAF (0.53) BRAFMAPK14TRPV1FGFR1
SCHEMBL27844954 0.80 BRAF (0.54) BRAFMAPK14RAF1KDREGFR
SCHEMBL27862199 0.80 BRAF (0.51) BRAFMAPK14TRPV1
SCHEMBL27845105 0.79 BRAF (0.52) BRAFMAPK14TRPV1
SCHEMBL27844947 0.78 BRAF (0.53) BRAFMAPK14KDREGFRTRPV1
SCHEMBL27844997 0.78 BRAF (0.57) BRAFMAPK14KDRTRPV1

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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