SCHEMBL14138573

SCHEMBL14138573

Cc1oc(S(=O)(=O)N2CCCCC2)cc1C(=O)N1N=C(c2cccnc2)CC1C1=C(O)CCC=C1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 19/20 0.41
▸ PKM P14618 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
SCHEMBL3597135 0.86 PKM (0.56) BRAFPKM
SCHEMBL3594031 0.86 PKM (0.57) BRAFPKM
SCHEMBL3601457 0.85 BRAF (0.51) BRAFPKM
SCHEMBL14138574 0.80 BRAF (0.48) BRAFPKM
SCHEMBL3602670 0.80 BRAF (0.55) BRAFPKM
SCHEMBL14138509 0.79 BRAF (0.47) BRAFPKM
SCHEMBL14138812 0.73 BRAF (0.42) BRAFPKM
SCHEMBL14138556 0.73 BRAF (0.73) BRAFPKM
SCHEMBL14138560 0.73 BRAF (0.43) BRAFPKM
SCHEMBL14138507 0.71 BRAF (0.49) BRAFPKM

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
WO-2008079277-A1 CERTAIN PYRAZOLINE DERIVATIVES WITH KINASE INHIBITORY ACTIVITY MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-07-03 — — WO disclosed
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