SCHEMBL22900328

SCHEMBL22900328

Cc1nn(C)c2c1C(=O)N(c1ccc3[nH]cnc3c1)C2c1ccc(Cl)cc1F

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BRD2 P25440 13/20 0.44
▸ BRD3 Q15059 13/20 0.44
▸ CREBBP Q92793 13/20 0.44
▸ BRD4 O60885 12/20 0.44
▸ QPCT Q16769 7/20 0.40

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
SCHEMBL22900459 0.89 QPCT (0.40) BRD2BRD3CREBBPBRD4QPCT
SCHEMBL22900325 0.83 QPCT (0.40) BRD2BRD3CREBBPBRD4QPCT
SCHEMBL22900168 0.83 QPCT (0.53) BRD2BRD3CREBBPBRD4QPCT
SCHEMBL22900466 0.80 BRD3 (0.46) BRD2BRD3CREBBPBRD4
SCHEMBL22900460 0.78 QPCT (0.40) BRD2BRD3CREBBPBRD4QPCT
SCHEMBL22900456 0.77 QPCT (0.51) BRD2BRD3CREBBPBRD4QPCT
SCHEMBL22900399 0.77 BRD4 (0.41) BRD2BRD3CREBBPBRD4QPCT
SCHEMBL22900430 0.76 QPCT (0.41) BRD2BRD3CREBBPBRD4QPCT
SCHEMBL22900454 0.76 QPCT (0.41) BRD2BRD3CREBBPBRD4QPCT
SCHEMBL22900166 0.75 QPCT (0.51) BRD4QPCT

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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