SCHEMBL22010646

SCHEMBL22010646

NC(=O)N1CC(C(F)(F)F)C1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SPR P35270 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
RIPK1 Q13546 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL22488585 0.82 SPR (0.47) SPRRXFP1SMN1; SMN2
SCHEMBL29359207 0.82 SPR (0.47) SPRRXFP1SMN1; SMN2
SCHEMBL20899871 0.80 SPR (0.34) SPRRXFP1RIPK1SMN1; SMN2
SCHEMBL28408901 0.80 RIPK1 (0.35) SPRRXFP1RIPK1SMN1; SMN2
SCHEMBL18312206 0.79 SPR (0.41) SPRRXFP1
SCHEMBL28692543 0.79 RXFP1 (0.49) RXFP1SMN1; SMN2
SCHEMBL19014078 0.78 CHRNB2 (0.46) SPRRXFP1RIPK1SMN1; SMN2
SCHEMBL15298469 0.75 ATM (0.38) SMN1; SMN2
SCHEMBL20221868 0.75 TACR1 (0.33) SPRRXFP1RIPK1SMN1; SMN2
SCHEMBL26644049 0.74 DPP4 (0.39)

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
WO-2020099882-A1 HETEROCYCLIC SPIRO-COMPOUNDS AS AM2 RECEPTOR INHIBITORS THE UNIVERSITY OF SHEFFIELD (GB) 2020-05-22 WO disclosed