SCHEMBL24364975

SCHEMBL24364975

COc1ccc(N)cc1-c1cn(CCC2CC2)c(=O)c2[nH]ccc12

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CECR2 Q9BXF3 1/20 0.75
▸ BRD9 Q9H8M2 5/20 0.56
▸ BRD4 O60885 14/20 0.54

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
SCHEMBL29482221 0.86 CECR2 (1.00) CECR2BRD9BRD4
SCHEMBL29482219 0.86 CECR2 (1.00) CECR2BRD9BRD4
SCHEMBL17749755 0.86 CECR2 (1.00) CECR2BRD9BRD4
SCHEMBL15069674 0.80 BRD4 (0.78) BRD4
SCHEMBL15069296 0.75 BRD4 (0.74) BRD4
SCHEMBL15069415 0.74 BRD4 (0.74) BRD4
SCHEMBL15069394 0.73 BRD4 (0.68) BRD4
SCHEMBL23436657 0.73 BRD4 (0.77) BRD4
SCHEMBL15069089 0.72 BRD4 (0.71) BRD4
SCHEMBL17749864 0.71 BRD9 (1.00) CECR2BRD9BRD4

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
EP-3218375-B1 SUBSTITUTED PYRROLOPYRDINES AS INHIBITORS OF BROMODOMAIN GENENTECH INC (US) 2022-04-27 — — EP disclosed
Send feedback