SCHEMBL27825462

SCHEMBL27825462

CCN1c2cccc(C(F)(F)F)c2CC1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 3/20 0.45
▸ P2RX7 Q99572 11/20 0.43
▸ CACNA1S Q13698 5/20 0.39
▸ TTR P02766 1/20 0.38

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
SCHEMBL27883829 0.81 NOTUM (0.47) NOTUMCACNA1STTR
SCHEMBL27825463 0.81 AADAT (0.44) NOTUMP2RX7
SCHEMBL27825543 0.74 AGTR2 (0.46) —
SCHEMBL9812500 0.73 ACE (0.53) —
SCHEMBL9812508 0.73 ACE (0.53) —
SCHEMBL27844514 0.73 AGTR2 (0.47) —
Hydrochloric Acid SCHEMBL9740832 0.72 ACE (0.52) —
SCHEMBL2428200 0.69 NOTUM (0.55) NOTUMCACNA1STTR
SCHEMBL19436082 0.69 CASP1 (0.35) —
SCHEMBL27825441 0.68 AGTR2 (0.40) —

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
CN-102239165-A Inhibitors of diacylglycerol acyltransferase VIA PHARMACEUTICALS INC 2011-11-09 — — CN disclosed
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