SCHEMBL24556532

SCHEMBL24556532

Cn1cc(-c2ccc(C(C)(O)N3CCNCC3)cc2)c2cc[nH]c2c1=O

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BRD9 Q9H8M2 9/20 0.70
▸ BRD4 O60885 7/20 0.57
▸ CECR2 Q9BXF3 5/20 0.53
▸ TAF1 P21675 2/20 0.53

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
SCHEMBL17756347 0.83 BRD9 (1.00) BRD9BRD4CECR2TAF1
SCHEMBL19869920 0.78 BRD4 (0.83) BRD9BRD4CECR2TAF1
SCHEMBL31590058 0.77 BRD9 (0.74) BRD9BRD4CECR2TAF1
SCHEMBL24866050 0.74 BRD4 (0.76) BRD9BRD4CECR2TAF1
SCHEMBL17748888 0.73 BRD4 (1.00) BRD9BRD4CECR2TAF1
SCHEMBL31589675 0.72 BRD4 (0.74) BRD9BRD4CECR2TAF1
SCHEMBL17748876 0.72 BRD4 (0.74) BRD9BRD4CECR2TAF1
SCHEMBL31590527 0.72 BRD4 (0.74) BRD9BRD4CECR2TAF1
SCHEMBL19869918 0.72 BRD4 (0.63) BRD9BRD4CECR2TAF1
SCHEMBL17748894 0.72 BRD4 (1.00) BRD9BRD4CECR2TAF1

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-3265453-B1 NEW PYRIDINONES AND ISOQUINOLINONES AS INHIBITORS OF THE BROMODOMAIN BRD9 BOEHRINGER INGELHEIM INT (DE) 2022-06-29 — — EP disclosed
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