SCHEMBL25975868

SCHEMBL25975868

Cc1noc(C)c1-c1ccc(CN)cc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 15/20 0.59
BRD2 P25440 5/20 0.59
NR3C1 P04150 1/20 0.54
PGR P06401 1/20 0.54
MLYCD O95822 1/20 0.50
CREBBP Q92793 3/20 0.48
BRD3 Q15059 1/20 0.48
JAK2 O60674 1/20 0.47
HRH3 Q9Y5N1 1/20 0.45
HCAR2 Q8TDS4 1/20 0.44

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
SCHEMBL12309796 0.84 BRD4 (0.61) BRD4BRD2NR3C1PGRMLYCD
SCHEMBL20946455 0.83 BRD4 (0.57) BRD4BRD2CREBBPBRD3
SCHEMBL3885694 0.79 BRD4 (0.66) BRD4BRD2NR3C1PGRMLYCD
SCHEMBL16415749 0.79 BRD4 (0.66) BRD4BRD2NR3C1PGRMLYCD
SCHEMBL17265577 0.79 BRD4 (0.56) BRD4BRD2NR3C1PGRMLYCD
SCHEMBL8300240 0.79 BRD4 (0.70) BRD4BRD2NR3C1PGRMLYCD
SCHEMBL16404607 0.76 BRD4 (0.66) BRD4BRD2MLYCD
SCHEMBL1772573 0.76 BRD4 (0.66) BRD4BRD2NR3C1PGRMLYCD
SCHEMBL14678367 0.76 BRD4 (0.66) BRD4BRD2MLYCDCREBBPBRD3
SCHEMBL12362813 0.76 BRD4 (0.66) BRD4BRD2MLYCDCREBBP

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-2023148643-A1 FUSED BICYCLIC HETEROCYCLYL COMPOUNDS AS USP1 INHIBITORS AURIGENE ONCOLOGY LIMITED (IN) 2023-08-10 WO disclosed