SCHEMBL17749785

SCHEMBL17749785

CC=CCn1cc(-c2cccc(C(N)=O)c2F)c2cc[nH]c2c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 10/20 1.00
▸ BRD9 Q9H8M2 8/20 0.79
▸ CECR2 Q9BXF3 5/20 0.64
▸ TAF1 P21675 3/20 0.56

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
SCHEMBL30073272 1.00 BRD4 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL17749781 1.00 BRD4 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL30073315 0.88 BRD9 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL17749860 0.88 BRD9 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL17749862 0.88 BRD9 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL17749796 0.81 BRD4 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL17749797 0.81 BRD4 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL17749672 0.80 BRD4 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL17749671 0.80 BRD4 (1.00) BRD4BRD9CECR2TAF1
SCHEMBL30073367 0.80 BRD4 (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 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
Send feedback