SCHEMBL16613003

SCHEMBL16613003

NC1Cc2cc(Oc3ccc4ccccc4n3)ccc2N(O)C1=O

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 18/20 0.67
KYAT3 Q6YP21 4/20 0.67
KYAT1 Q16773 3/20 0.67
GOT1 P17174 1/20 0.50

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
SCHEMBL3768160 0.86 AADAT (0.65) AADATKYAT3KYAT1GOT1
SCHEMBL3775216 0.83 AADAT (0.64) AADATKYAT3KYAT1GOT1
SCHEMBL6763354 0.81 AADAT (0.71) AADATKYAT3KYAT1GOT1
SCHEMBL2143232 0.81 AADAT (1.00) AADATKYAT3KYAT1GOT1
SCHEMBL3769901 0.80 AADAT (0.59) AADATKYAT3KYAT1GOT1
SCHEMBL3781828 0.80 AADAT (0.65) AADATKYAT3KYAT1GOT1
SCHEMBL16613086 0.80 AADAT (0.61) AADATKYAT3KYAT1GOT1
SCHEMBL3776633 0.79 AADAT (0.64) AADATKYAT3KYAT1GOT1
SCHEMBL16613060 0.79 AADAT (0.60) AADATKYAT3KYAT1GOT1
SCHEMBL16613024 0.78 AADAT (0.63) 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