SCHEMBL17749875

SCHEMBL17749875

CC=CCn1cc(-c2ccc(C(N)=O)c(Cl)c2)c2cc[nH]c2c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CECR2 Q9BXF3 6/20 1.00
▸ BRD4 O60885 10/20 0.80
▸ BRD9 Q9H8M2 6/20 0.77
▸ TAF1 P21675 4/20 0.62

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
SCHEMBL17749874 1.00 CECR2 (1.00) CECR2BRD4BRD9TAF1
SCHEMBL17749845 0.89 CECR2 (1.00) CECR2BRD4BRD9TAF1
SCHEMBL17749842 0.89 CECR2 (1.00) CECR2BRD4BRD9TAF1
SCHEMBL17749797 0.89 BRD4 (1.00) CECR2BRD4BRD9TAF1
SCHEMBL17749796 0.89 BRD4 (1.00) CECR2BRD4BRD9TAF1
SCHEMBL30073209 0.87 BRD9 (1.00) CECR2BRD4BRD9TAF1
SCHEMBL17749688 0.87 BRD9 (1.00) CECR2BRD4BRD9TAF1
SCHEMBL17749689 0.87 BRD9 (1.00) CECR2BRD4BRD9TAF1
SCHEMBL30073396 0.85 BRD9 (1.00) CECR2BRD4BRD9TAF1
SCHEMBL17758608 0.85 BRD9 (1.00) CECR2BRD4BRD9TAF1

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 4 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 claimed
WO-2016077378-A1 SUBSTITUTED PYRROLOPYRDINES AS INHIBITORS OF BROMODOMAIN GENENTECH, INC. (US) 2016-05-19 — — WO claimed
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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