SCHEMBL17749888

SCHEMBL17749888

CC=CCn1cc(-c2cc(F)cc(C(=O)Nc3ccccc3)c2)c2cc[nH]c2c1=O

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 8/20 0.73
▸ BRD9 Q9H8M2 7/20 0.70
▸ CECR2 Q9BXF3 5/20 0.62
▸ TAF1 P21675 3/20 0.57

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
SCHEMBL17749887 1.00 BRD4 (0.73) BRD4BRD9CECR2TAF1
SCHEMBL30073340 0.84 BRD4 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL17749742 0.83 BRD9 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL30073291 0.83 BRD9 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL17749745 0.83 BRD9 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL24363703 0.78 BRD4 (0.71) BRD4BRD9CECR2TAF1
SCHEMBL19640306 0.77 CECR2 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL19640308 0.77 CECR2 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL30073278 0.77 CECR2 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL19640299 0.75 BRD9 (1.00) BRD4BRD9CECR2TAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3218375-A1 SUBSTITUTED PYRROLOPYRDINES AS INHIBITORS OF BROMODOMAIN Genentech, Inc. (US) 2017-09-20 — — EP disclosed
WO-2016077378-A1 SUBSTITUTED PYRROLOPYRDINES AS INHIBITORS OF BROMODOMAIN GENENTECH, INC. (US) 2016-05-19 — — WO disclosed
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