SCHEMBL16612824

SCHEMBL16612824

CN(Cc1ccc2c(c1)C[C@H](N)C(=O)N2O)c1c(F)cccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 19/20 0.50
KYAT3 Q6YP21 4/20 0.43
KYAT1 Q16773 3/20 0.43
GOT1 P17174 1/20 0.43

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
SCHEMBL3783103 0.93 AADAT (0.52) AADATKYAT3KYAT1GOT1
SCHEMBL3775672 0.86 AADAT (0.50) AADATKYAT3KYAT1GOT1
SCHEMBL3783101 0.84 AADAT (0.49) AADATKYAT3KYAT1GOT1
SCHEMBL3781452 0.84 AADAT (0.54) AADATKYAT3KYAT1GOT1
SCHEMBL3773427 0.83 AADAT (0.54) AADATKYAT3KYAT1GOT1
SCHEMBL3774745 0.82 AADAT (0.51) AADATKYAT3KYAT1GOT1
SCHEMBL3786009 0.82 AADAT (0.51) AADATKYAT3KYAT1GOT1
SCHEMBL3773505 0.82 AADAT (0.60) AADATKYAT3KYAT1GOT1
SCHEMBL3773456 0.81 AADAT (0.50) AADATKYAT3KYAT1GOT1
SCHEMBL3774454 0.81 AADAT (0.59) 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