SCHEMBL16613188

SCHEMBL16613188

N[C@H]1Cc2ccc(C3CCCCC3)cc2N(O)C1=O

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 18/20 0.60
KYAT3 Q6YP21 4/20 0.56
KYAT1 Q16773 3/20 0.56
GOT1 P17174 1/20 0.55

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
SCHEMBL3786012 0.96 AADAT (0.62) AADATKYAT3KYAT1GOT1
SCHEMBL3775992 0.88 AADAT (0.62) AADATKYAT3KYAT1GOT1
SCHEMBL3775113 0.85 AADAT (0.62) AADATKYAT3KYAT1GOT1
SCHEMBL5132076 0.82 AADAT (0.65) AADATKYAT3KYAT1GOT1
SCHEMBL3775097 0.76 AADAT (0.68) AADATKYAT3KYAT1GOT1
SCHEMBL6763551 0.76 AADAT (0.58) AADATKYAT3KYAT1GOT1
SCHEMBL3781672 0.76 AADAT (0.68) AADATKYAT3KYAT1GOT1
SCHEMBL6763283 0.76 AADAT (1.00) AADATKYAT3KYAT1GOT1
SCHEMBL2125876 0.76 AADAT (1.00) AADATKYAT3KYAT1GOT1
SCHEMBL7423257 0.76 AADAT (1.00) AADATKYAT3KYAT1GOT1

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