SCHEMBL22900445

SCHEMBL22900445

Cc1c2c(nn1COCC[Si](C)(C)C)C(=O)N(c1ccc3c(c1)ncn3COCC[Si](C)(C)C)C2c1ccc(Br)cc1F

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 11/20 0.41
▸ BRD2 P25440 10/20 0.41
▸ BRD3 Q15059 10/20 0.41
▸ CREBBP Q92793 10/20 0.41
▸ QPCT Q16769 1/20 0.38
▸ DGAT1 O75907 2/20 0.37
▸ MDM2 Q00987 2/20 0.34
▸ MDM4 O15151 1/20 0.34

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
SCHEMBL22900354 0.93 BRD4 (0.38) BRD4BRD2BRD3CREBBPQPCT
SCHEMBL22900452 0.91 MDM2 (0.41) BRD4BRD2BRD3CREBBPQPCT
SCHEMBL22900491 0.90 BRD4 (0.36) BRD4BRD2BRD3CREBBPQPCT
SCHEMBL22900185 0.87 BRD4 (0.38) BRD4BRD2BRD3CREBBPMDM2
SCHEMBL22900484 0.87 BRD4 (0.44) BRD4BRD2BRD3CREBBPQPCT
SCHEMBL22900458 0.87 BRD2 (0.38) BRD4BRD2BRD3CREBBPQPCT
SCHEMBL22900499 0.86 BRD4 (0.39) BRD4BRD2BRD3CREBBPDGAT1
SCHEMBL22900183 0.85 QPCT (0.37) BRD4BRD2BRD3CREBBPQPCT
SCHEMBL22900497 0.85 BRD4 (0.38) BRD4BRD2BRD3CREBBPQPCT
SCHEMBL22900418 0.84 QPCT (0.36) BRD4CREBBPQPCTDGAT1

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
Send feedback