SCHEMBL30073232

SCHEMBL30073232

C/C=C/Cn1cc(-c2cc(C(=O)N3CCCC3)ccc2OC)c2cc[nH]c2c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 10/20 1.00
CECR2 Q9BXF3 2/20 0.97
TAF1 P21675 2/20 0.73
BRD4 O60885 6/20 0.71
BRD7 Q9NPI1 1/20 0.67

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
SCHEMBL17749849 1.00 BRD9 (1.00) BRD9CECR2TAF1BRD4BRD7
SCHEMBL17749790 1.00 BRD9 (1.00) BRD9CECR2TAF1BRD4BRD7
SCHEMBL29482225 0.98 CECR2 (1.00) BRD9CECR2TAF1BRD4BRD7
SCHEMBL17758518 0.98 CECR2 (1.00) BRD9CECR2TAF1BRD4BRD7
SCHEMBL19657354 0.93 BRD9 (0.87) BRD9CECR2TAF1BRD4BRD7
SCHEMBL17749761 0.88 CECR2 (1.00) BRD9CECR2TAF1BRD4BRD7
SCHEMBL17749758 0.88 CECR2 (1.00) BRD9CECR2TAF1BRD4BRD7
SCHEMBL24363684 0.87 CECR2 (0.80) BRD9CECR2TAF1BRD4BRD7
SCHEMBL17749895 0.87 BRD9 (0.81) BRD9CECR2BRD4BRD7
SCHEMBL30073548 0.87 BRD9 (0.81) BRD9CECR2BRD4BRD7

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
CN-115583947-A Substituted pyrrolopyridines as bromodomain inhibitors 基因泰克公司 2023-01-10 CN claimed
CN-116003409-A Substituted pyrrolopyridines as bromodomain inhibitors 基因泰克公司 2023-04-25 CN disclosed
CN-107207493-B Substituted pyrrolopyridines as bromodomain inhibitors 基因泰克公司 2023-01-20 CN disclosed
CN-115583947-A Substituted pyrrolopyridines as bromodomain inhibitors 基因泰克公司 2023-01-10 CN disclosed