SCHEMBL22900221

SCHEMBL22900221

Cc1nc2c(s1)C(c1ccc(N3CCC(F)(F)C3)cc1F)N(c1ccc3[nH]cnc3c1)C2=O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 17/20 0.53
▸ TPH1 P17752 2/20 0.32
▸ JAK2 O60674 1/20 0.32

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
SCHEMBL22900208 0.84 QPCT (0.54) QPCT
SCHEMBL22900251 0.84 QPCT (0.54) QPCT
SCHEMBL22900399 0.83 BRD4 (0.41) QPCT
SCHEMBL22900246 0.82 QPCT (0.52) QPCT
SCHEMBL22900343 0.82 QPCT (0.53) QPCT
SCHEMBL22900516 0.81 QPCT (0.52) QPCT
SCHEMBL22900524 0.81 QPCT (0.52) QPCT
SCHEMBL22900596 0.81 QPCT (0.55) QPCT
SCHEMBL22900292 0.81 QPCT (0.55) QPCT
SCHEMBL22900287 0.80 QPCT (0.58) 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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