SCHEMBL19869744

SCHEMBL19869744

COc1cc(-c2cc(C)c(=O)n(C)c2)c(OC)cc1CN(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 17/20 1.00
BRD4 O60885 16/20 1.00
BRD7 Q9NPI1 10/20 0.68
BRD2 P25440 7/20 0.68
TAF1 P21675 2/20 0.56
TGFBR1 P36897 2/20 0.56
ACVR1 Q04771 2/20 0.56
CREBBP Q92793 2/20 0.56
CECR2 Q9BXF3 2/20 0.56
CYP2D6 P10635 1/20 0.56
ACVR2B Q13705 1/20 0.56
BRD8 Q9H0E9 1/20 0.56
NOS1 P29475 1/20 0.42
BRPF1 P55201 1/20 0.42
BPTF Q12830 1/20 0.42
TAF1L Q8IZX4 1/20 0.42
BAZ2B Q9UIF8 1/20 0.42
ATAD2B Q9ULI0 1/20 0.42

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
SCHEMBL19869840 0.82 BRD4 (1.00) BRD9BRD4BRD7BRD2TAF1
SCHEMBL23134697 0.81 BRD4 (0.67) BRD9BRD4BRD7BRD2
SCHEMBL19869776 0.81 BRD9 (1.00) BRD9BRD4BRD7BRD2TAF1
SCHEMBL19869726 0.79 BRD4 (0.65) BRD9BRD4BRD7BRD2
SCHEMBL19869785 0.79 BRD9 (1.00) BRD9BRD4BRD7BRD2TAF1
SCHEMBL19869713 0.78 BRD9 (1.00) BRD9BRD4BRD7BRD2TAF1
SCHEMBL19857679 0.77 BRD9 (1.00) BRD9BRD4BRD7BRD2TAF1
SCHEMBL19869811 0.77 BRD4 (0.62) BRD9BRD4BRD7BRD2
SCHEMBL19869719 0.77 BRD4 (0.68) BRD9BRD4BRD7BRD2
SCHEMBL19869876 0.77 BRD4 (1.00) BRD9BRD4BRD7BRD2TAF1

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-3265453-B1 NEW PYRIDINONES AND ISOQUINOLINONES AS INHIBITORS OF THE BROMODOMAIN BRD9 BOEHRINGER INGELHEIM INT (DE) 2022-06-29 EP disclosed
US-11319318-B2 Pyridinones and isoquinolinones as inhibitors of the bromodomain BRD9 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-05-03 US disclosed
US-20180044335-A1 New Pyridinones and Isoquinolinones as Inhibitors of the Bromodomain BRD9 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-02-15 US disclosed
US-20180044335-A1 New Pyridinones and Isoquinolinones as Inhibitors of the Bromodomain BRD9 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-02-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180044335-A1 New Pyridinones and Isoquinolinones as Inhibitors of the Bromodomain BRD9 BRD9, BRD1, BRD2 BRD9 1/4885BRD4 5/4885BRD7 6/4885
US-11319318-B2 Pyridinones and isoquinolinones as inhibitors of the bromodomain BRD9 BRD9, BRD1, BRD2 BRD9 1/4885BRD4 6/4885BRD7 5/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.