SCHEMBL22900166

SCHEMBL22900166

Cc1c2c(nn1C)C(c1ccc(Br)cc1F)N(c1ccc3[nH]cnc3c1)C2=O

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 18/20 0.51
▸ BRD4 O60885 1/20 0.34
▸ NMT1 P30419 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
SCHEMBL22900256 0.86 QPCT (0.54) QPCTBRD4
SCHEMBL22900169 0.83 QPCT (0.53) QPCT
SCHEMBL22900456 0.82 QPCT (0.51) QPCTBRD4
SCHEMBL22900422 0.81 QPCT (0.37) QPCTNMT1
SCHEMBL22900401 0.78 BRD4 (0.44) QPCTBRD4
SCHEMBL22900181 0.78 QPCT (0.52) QPCTBRD4
SCHEMBL22900255 0.78 QPCT (0.54) QPCT
SCHEMBL22900418 0.77 QPCT (0.36) QPCTBRD4
Methane SCHEMBL28792330 0.76 QPCT (0.66) QPCT
SCHEMBL22900521 0.75 QPCT (0.51) 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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