SCHEMBL22900422

SCHEMBL22900422

Cc1c2c(nn1C)C(c1ccc(Br)cc1F)N(c1ccc3c(c1)ncn3SF)C2=O

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 1/20 0.37
▸ NMT1 P30419 1/20 0.32
▸ SIK1 P57059 1/20 0.30
▸ SIK2 Q9H0K1 1/20 0.30
▸ SIK3 Q9Y2K2 1/20 0.30

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
SCHEMBL22900166 0.81 QPCT (0.51) QPCTNMT1
SCHEMBL22900418 0.81 QPCT (0.36) QPCT
SCHEMBL22900514 0.72 BRD3 (0.43) QPCT
SCHEMBL22900475 0.71 BRD3 (0.37) —
SCHEMBL22900473 0.70 BRD3 (0.35) —
SCHEMBL22900354 0.68 BRD4 (0.38) QPCT
SCHEMBL22900256 0.67 QPCT (0.54) QPCT
SCHEMBL22900456 0.64 QPCT (0.51) QPCT
SCHEMBL22900540 0.63 BRD4 (0.42) QPCT
SCHEMBL22900276 0.58 NMT1 (0.41) QPCTNMT1

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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