SCHEMBL16613181

SCHEMBL16613181

N[C@H]1Cc2cccc(Cc3ccccc3)c2N(O)C1=O

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 19/20 0.63
GOT1 P17174 1/20 0.54
KYAT1 Q16773 1/20 0.54
KYAT3 Q6YP21 1/20 0.54

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
SCHEMBL16613182 1.00 AADAT (0.63) AADATGOT1KYAT1KYAT3
SCHEMBL6763482 0.83 AADAT (0.69) AADATGOT1KYAT1KYAT3
SCHEMBL6763287 0.77 AADAT (1.00) AADATGOT1KYAT1KYAT3
SCHEMBL6763408 0.77 AADAT (0.63) AADATGOT1KYAT1KYAT3
SCHEMBL3786074 0.76 AADAT (0.59) AADATGOT1KYAT1KYAT3
SCHEMBL16613099 0.76 AADAT (0.62) AADATGOT1KYAT1KYAT3
SCHEMBL3779760 0.75 AADAT (0.54) AADATGOT1KYAT1KYAT3
SCHEMBL16613038 0.75 AADAT (0.68) AADATGOT1KYAT1KYAT3
SCHEMBL16612959 0.75 AADAT (1.00) AADATGOT1KYAT1KYAT3
SCHEMBL3774305 0.75 AADAT (1.00) AADATGOT1KYAT1KYAT3

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 disclosed