SCHEMBL9856896

SCHEMBL9856896

CCCC/C=C/Sc1ncc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)n1Cc1ccccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 2/20 0.41
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 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
SCHEMBL9473316 1.00 FAAH (0.41) FAAHCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL9473895 0.88 MEN1 (0.42) MEN1KMT2A
SCHEMBL9473912 0.88 MEN1 (0.42) MEN1KMT2A
SCHEMBL9473565 0.85 SCN3A (0.41) MEN1KMT2A
SCHEMBL9857009 0.85 SCN3A (0.41) FAAHMEN1KMT2A
SCHEMBL9857334 0.85 SCN3A (0.41) FAAHMEN1KMT2A
SCHEMBL9474084 0.84 MEN1 (0.42) MEN1KMT2A
SCHEMBL9473162 0.84 MEN1 (0.42) MEN1KMT2A
SCHEMBL9473272 0.82 MAPT (0.45) MEN1KMT2A
SCHEMBL9856770 0.80 ITGA4 (0.44) —

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
EP-0437103-A2 Substituted 5-(alkyl)carboxamide imidazoles SMITHKLINE BEECHAM CORPORATION (US) 1991-07-17 — — EP disclosed
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