SCHEMBL27862284

SCHEMBL27862284

Cc1nc(Nc2cc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)ccc2C)nc(N2CCN(Cc3ccccc3)CC2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 9/20 0.53
▸ MAPK14 Q16539 1/20 0.53
▸ FAAH O00519 1/20 0.46
▸ MAPT P10636 4/20 0.46
▸ MAPK1 P28482 3/20 0.46
▸ GAA P10253 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ XBP1 P17861 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ NPY2R P49146 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ LMNA P02545 3/20 0.45
▸ TRPV1 Q8NER1 4/20 0.44
▸ HTT P42858 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ CDK1 P06493 1/20 0.43
▸ IGF1R P08069 1/20 0.43
▸ FGFR1 P11362 1/20 0.43
▸ FGFR2 P21802 1/20 0.43

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
SCHEMBL27844954 0.93 BRAF (0.54) BRAFMAPK14MAPTMAPK1GAA
SCHEMBL27862199 0.90 BRAF (0.51) BRAFMAPK14MAPTGAAALDH1A1
SCHEMBL27844947 0.89 BRAF (0.53) BRAFMAPK14MAPTGAAALDH1A1
SCHEMBL27845105 0.89 BRAF (0.52) BRAFMAPK14MAPTGAAKMT2A
SCHEMBL27844945 0.89 BRAF (0.50) BRAFMAPK14MAPTMAPK1GAA
SCHEMBL27844949 0.89 BRAF (0.52) BRAFMAPK14MAPTGAAALDH1A1
SCHEMBL27844997 0.88 BRAF (0.57) BRAFMAPK14TRPV1
SCHEMBL27845008 0.88 BRAF (0.51) BRAFMAPK14MAPTMAPK1GAA
SCHEMBL27862197 0.86 BRAF (0.55) BRAFMAPK14TRPV1
SCHEMBL27862531 0.86 BRAF (0.52) BRAFMAPK14TRPV1

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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