SCHEMBL19930995

SCHEMBL19930995

CNC1C=C(c2cc(SC(C)C)ccc2OCC2CC2)C=C1C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.34
EP300 Q09472 1/20 0.34
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
AR P10275 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
SCHEMBL19931105 0.88 BRD4 (0.35) BRD4EP300
SCHEMBL19930893 0.87 BRD4 (0.35) BRD4EP300PDE4BAR
SCHEMBL19931208 0.77 BRD4 (0.30) BRD4EP300AR
SCHEMBL19931045 0.76 PDE4A (0.32) BRD4EP300PDE4APDE4BPDE4C
SCHEMBL19931222 0.76 BRD4 (0.33) BRD4EP300PDE4APDE4BPDE4C
SCHEMBL19930964 0.76 BRD4 (0.33) BRD4EP300PDE4BAR
SCHEMBL25043121 0.75 BRD4 (0.34) BRD4EP300AR
SCHEMBL19930852 0.75 BRD4 (0.32) BRD4EP300AR
SCHEMBL19930937 0.74 BRD4 (0.36) BRD4
SCHEMBL19930879 0.72 PTGER1 (0.34) BRD4EP300PDE4APDE4BPDE4C

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4134364-A2 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2023-02-15 EP disclosed
EP-3640241-A1 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc. (US) 2020-04-22 EP disclosed
EP-3290407-A1 BROMODOMAIN INHIBITORS Celgene Quanticel Research, Inc (US) 2018-03-07 EP disclosed