SCHEMBL22900416

SCHEMBL22900416

Cn1nc(C(F)(F)F)c2c1C(c1ccc(Cl)cc1F)N(c1ccc3c(c1)ncn3COCC[Si](C)(C)C)C2=O

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 9/20 0.34
▸ BRD4 O60885 8/20 0.34
▸ BRD2 P25440 8/20 0.34
▸ BRD3 Q15059 8/20 0.34
▸ MDM2 Q00987 5/20 0.32
▸ TP53 P04637 1/20 0.32
▸ DYRK3 O43781 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ MAPK8 P45983 1/20 0.31
▸ MAPK9 P45984 1/20 0.31
▸ MAPK10 P53779 1/20 0.31
▸ DYRK1A Q13627 1/20 0.31
▸ NTRK3 Q16288 1/20 0.31
▸ PIM3 Q86V86 1/20 0.31
▸ SRPK1 Q96SB4 1/20 0.31
▸ CLK4 Q9HAZ1 1/20 0.31
▸ MDM4 O15151 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
SCHEMBL22900326 0.91 BRD2 (0.40) CREBBPBRD4BRD2BRD3MDM2
SCHEMBL22900324 0.90 CREBBP (0.35) CREBBPBRD4BRD2BRD3MDM2
SCHEMBL22900318 0.86 QPCT (0.39) CREBBPBRD4
SCHEMBL22900327 0.84 BRD4 (0.34) CREBBPBRD4BRD2BRD3MDM2
SCHEMBL22900431 0.79 CREBBP (0.33) CREBBPBRD4BRD2BRD3MDM2
SCHEMBL22900453 0.79 BRD4 (0.36) CREBBPBRD4BRD2BRD3MDM2
SCHEMBL22900459 0.78 QPCT (0.40) CREBBPBRD4BRD2BRD3MDM2
SCHEMBL22900398 0.78 BRD4 (0.36) CREBBPBRD4BRD2BRD3MDM2
SCHEMBL22900461 0.78 BRD4 (0.34) CREBBPBRD4BRD2BRD3MDM2
SCHEMBL22900438 0.78 BRD4 (0.33) CREBBPBRD4BRD2BRD3MDM2

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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