SCHEMBL16612959

SCHEMBL16612959

NC1Cc2cccc(F)c2N(O)C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 19/20 1.00
KYAT1 Q16773 3/20 0.58
KYAT3 Q6YP21 3/20 0.58
GOT1 P17174 1/20 0.58

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
SCHEMBL6763318 1.00 AADAT (1.00) AADATKYAT1KYAT3GOT1
SCHEMBL6763287 0.81 AADAT (1.00) AADATKYAT1KYAT3GOT1
SCHEMBL3774305 0.81 AADAT (1.00) AADATKYAT1KYAT3GOT1
SCHEMBL16613038 0.81 AADAT (0.68) AADATKYAT1KYAT3GOT1
SCHEMBL5131772 0.81 AADAT (1.00) AADATKYAT1KYAT3GOT1
SCHEMBL5132062 0.81 AADAT (0.68) AADATKYAT1KYAT3GOT1
SCHEMBL3773448 0.81 AADAT (1.00) AADATKYAT1KYAT3GOT1
SCHEMBL16612811 0.79 AADAT (0.65) AADATKYAT1KYAT3GOT1
SCHEMBL6763482 0.79 AADAT (0.69) AADATKYAT1KYAT3GOT1
SCHEMBL6763682 0.78 AADAT (0.64) AADATKYAT1KYAT3GOT1

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-2443092-B1 BICYCLIC AND TRICYCLIC COMPOUNDS AS KAT II INHIBITORS PFIZER (US) 2015-04-08 EP claimed