SCHEMBL22900241

SCHEMBL22900241

CN/C(C)=C1\C(=N)C(=O)N(c2ccc3[nH]cnc3c2)C1c1ccc(N2CCC(F)(F)C2)c(F)c1F

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 18/20 0.53
▸ ACACB O00763 1/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ CNR2 P34972 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
SCHEMBL22900682 0.83 QPCT (0.56) QPCT
SCHEMBL22900248 0.79 QPCT (0.39) QPCT
SCHEMBL22900350 0.79 QPCT (0.55) QPCT
SCHEMBL22900342 0.78 QPCT (0.54) QPCT
SCHEMBL22900575 0.78 QPCT (0.54) QPCT
SCHEMBL16053682 0.76 QPCT (0.88) QPCT
SCHEMBL17476410 0.76 QPCT (0.88) QPCT
SCHEMBL29410458 0.76 QPCT (0.88) QPCT
SCHEMBL22900292 0.72 QPCT (0.55) QPCT
SCHEMBL22900288 0.72 QPCT (0.52) QPCT

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-2021009068-A1 N-SUBSTITUTED-3,4-(FUSED 5-RING)-5-PHENYL-PYRROLIDINE-2-ONE COMPOUNDS AS INHIBITORS OF ISOQC AND/OR QC ENZYME SCENIC IMMUNOLOGY B.V. (NL) 2021-01-21 — — WO disclosed
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