SCHEMBL24364224

SCHEMBL24364224

CNC(=O)c1cccc(-c2cn(CCOC)c(=O)c3[nH]ccc23)c1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CECR2 Q9BXF3 7/20 0.77
▸ TAF1 P21675 4/20 0.76
▸ BRD4 O60885 10/20 0.61
▸ BRD9 Q9H8M2 8/20 0.61
▸ TRIM24 O15164 1/20 0.55
▸ SMARCA2 P51531 1/20 0.55
▸ SMARCA4 P51532 1/20 0.55
▸ BRPF1 P55201 1/20 0.55
▸ EP300 Q09472 1/20 0.55
▸ PBRM1 Q86U86 1/20 0.55
▸ CREBBP Q92793 1/20 0.55
▸ BAZ2B Q9UIF8 1/20 0.55
▸ BAZ2A Q9UIF9 1/20 0.55

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
SCHEMBL30073254 0.87 CECR2 (1.00) CECR2TAF1BRD4BRD9TRIM24
SCHEMBL17749735 0.87 CECR2 (1.00) CECR2TAF1BRD4BRD9TRIM24
SCHEMBL17748918 0.86 TAF1 (1.00) CECR2TAF1BRD4BRD9TRIM24
SCHEMBL19640306 0.84 CECR2 (1.00) CECR2TAF1BRD4BRD9
SCHEMBL19640308 0.84 CECR2 (1.00) CECR2TAF1BRD4BRD9
SCHEMBL30073278 0.84 CECR2 (1.00) CECR2TAF1BRD4BRD9
SCHEMBL17749863 0.82 CECR2 (1.00) CECR2TAF1BRD4BRD9TRIM24
SCHEMBL30073239 0.82 CECR2 (1.00) CECR2TAF1BRD4BRD9TRIM24
SCHEMBL17749700 0.76 BRD4 (1.00) CECR2TAF1BRD4BRD9
SCHEMBL17749701 0.76 BRD4 (1.00) CECR2TAF1BRD4BRD9

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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