SCHEMBL22900531

SCHEMBL22900531

Cc1onc2c1C(c1ccc(-c3cnn(C(F)(F)F)c3)cc1F)N(c1ccc3c(c1)ncn3COCC[Si](C)(C)C)C2=O

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.31
▸ CREBBP Q92793 1/20 0.31
▸ MDM2 Q00987 1/20 0.30
▸ DGAT1 O75907 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
SCHEMBL22900569 0.90 BRD4 (0.31) BRD4CREBBPDGAT1
SCHEMBL22900332 0.81 QPCT (0.37) BRD4CREBBP
SCHEMBL24816665 0.80 BRD4 (0.34) BRD4CREBBPDGAT1
SCHEMBL26833793 0.80 BRD4 (0.34) BRD4CREBBPDGAT1
SCHEMBL30166841 0.80 BRD4 (0.34) BRD4CREBBPDGAT1
SCHEMBL22900736 0.77 BRD4 (0.38) BRD4CREBBPMDM2
SCHEMBL22900529 0.76 BRD4 (0.37) BRD4CREBBPMDM2DGAT1
SCHEMBL22900499 0.76 BRD4 (0.39) BRD4CREBBPMDM2DGAT1
SCHEMBL22900446 0.75 QPCT (0.37) BRD4CREBBPMDM2DGAT1
SCHEMBL22900183 0.75 QPCT (0.37) BRD4CREBBPMDM2DGAT1

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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