SCHEMBL5593458

SCHEMBL5593458

Cc1ccc(NC(=O)c2cc(F)cc(N3CCOCC3)c2)cc1-c1cc(C(=O)O)[nH]n1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.61
RAF1 P04049 7/20 0.61
MAPK14 Q16539 11/20 0.54
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49

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
SCHEMBL5623710 0.89 RAF1 (0.50) BRAFRAF1
SCHEMBL4541538 0.89 RAF1 (0.56) BRAFRAF1MAPK14
SCHEMBL4544153 0.87 RAF1 (0.55) BRAFRAF1MAPK14
SCHEMBL14473261 0.87 RAF1 (0.56) BRAFRAF1MAPK14
SCHEMBL14473262 0.86 RAF1 (0.54) BRAFRAF1MAPK14
SCHEMBL14473260 0.85 RAF1 (0.53) BRAFRAF1MAPK14
SCHEMBL4551205 0.83 RAF1 (0.62) BRAFRAF1MAPK14CYP3A4CYP2C9
SCHEMBL5593026 0.79 RAF1 (0.61) BRAFRAF1MAPK14CYP3A4CYP2C9
SCHEMBL4827472 0.79 RAF1 (0.64) BRAFRAF1MAPK14CYP3A4CYP2C9
SCHEMBL5592994 0.78 RAF1 (0.48) BRAFRAF1

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-2007075896-A2 HETEROCYCLIC CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-07-05 WO disclosed