SCHEMBL22900503

SCHEMBL22900503

Cc1c2c(nn1C)C(=O)N(c1ccc3c(c1)ncn3C)C2c1ccc(-n2cc(C(F)(F)F)cn2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 18/20 0.42
▸ BRD2 P25440 17/20 0.42
▸ BRD3 Q15059 17/20 0.42
▸ CREBBP Q92793 10/20 0.40
▸ CMA1 P23946 1/20 0.34
▸ MDM4 O15151 1/20 0.33
▸ MDM2 Q00987 1/20 0.33

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
SCHEMBL22900508 0.86 QPCT (0.41) BRD4BRD2BRD3CREBBP
SCHEMBL22900529 0.86 BRD4 (0.37) BRD4BRD2BRD3CREBBPMDM2
SCHEMBL22900506 0.84 BRD4 (0.38) BRD4BRD2BRD3CREBBPMDM4
SCHEMBL22900499 0.80 BRD4 (0.39) BRD4BRD2BRD3CREBBPMDM4
SCHEMBL22900736 0.77 BRD4 (0.38) BRD4BRD2BRD3CREBBPMDM2
SCHEMBL22900567 0.77 BRD2 (0.36) BRD4BRD2BRD3CREBBP
SCHEMBL22900229 0.76 QPCT (0.39) BRD4BRD2BRD3CREBBP
SCHEMBL22900731 0.73 BRD4 (0.46) BRD4BRD2BRD3CREBBPMDM2
SCHEMBL22900514 0.71 BRD3 (0.43) BRD4BRD2BRD3CREBBP
SCHEMBL22900724 0.71 BRD2 (0.39) BRD4BRD2BRD3CREBBP

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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