SCHEMBL24363724

SCHEMBL24363724

C=CCCn1cc(Br)c2cc[nH]c2c1=O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CECR2 Q9BXF3 20/20 0.52
▸ TAF1 P21675 18/20 0.52
▸ BRD9 Q9H8M2 18/20 0.52
▸ BRD4 O60885 17/20 0.52

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
SCHEMBL17748870 0.79 BRD9 (0.57) CECR2BRD9BRD4
SCHEMBL15069208 0.72 BRD4 (0.58) CECR2TAF1BRD9BRD4
SCHEMBL24363723 0.71 PDE4A (0.31) CECR2TAF1BRD9BRD4
SCHEMBL30143873 0.71 CECR2 (0.50) CECR2TAF1BRD9BRD4
SCHEMBL17749861 0.69 BRD4 (1.00) CECR2TAF1BRD9BRD4
SCHEMBL17752990 0.69 TAF1 (0.55) CECR2TAF1BRD9BRD4
SCHEMBL19657249 0.69 PDE4A (0.32) CECR2TAF1BRD9BRD4
SCHEMBL19658431 0.68 CECR2 (0.49) CECR2TAF1BRD9BRD4
SCHEMBL17758551 0.67 CECR2 (0.81) CECR2TAF1BRD9BRD4
SCHEMBL17749881 0.67 CECR2 (1.00) CECR2TAF1BRD9BRD4

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
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