SCHEMBL17879712

SCHEMBL17879712

CCc1ccccc1-c1cn(C)c(=O)c2c1cc(CC)n2C

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 17/20 0.43
BRD9 Q9H8M2 2/20 0.38
BRD7 Q9NPI1 2/20 0.38
BRD2 P25440 1/20 0.37
BRDT Q58F21 1/20 0.35
NPEPPS P55786 1/20 0.35

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
SCHEMBL17879714 0.91 BRD4 (0.43) BRD4BRD9BRD7BRD2
SCHEMBL17879711 0.86 BRD4 (0.46) BRD4BRD9BRD7BRD2BRDT
SCHEMBL18086995 0.83 BRD4 (0.43) BRD4BRD9BRD7BRD2BRDT
SCHEMBL17879721 0.82 BRD4 (0.54) BRD4
SCHEMBL15788355 0.79 BRD4 (0.45) BRD4BRD9BRD7BRD2
SCHEMBL17879720 0.78 BRD4 (0.56) BRD4
SCHEMBL17879715 0.76 BRD4 (0.41) BRD4BRD9BRD7BRD2BRDT
SCHEMBL17879716 0.69 BRD4 (0.49) BRD4BRD9BRD7
SCHEMBL19930928 0.67 BRD4 (0.51) BRD4BRD9BRD7BRD2BRDT
SCHEMBL198461 0.66 CSNK2A2 (0.52)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9957263-B2 Bromodomain inhibitors ABBVIE INC. (US) 2018-05-01 US disclosed
US-20160272630-A1 Bromodomain Inhibitors ABBVIE INC. (US) 2016-09-22 US disclosed
US-20160185769-A1 Bromodomain Inhibitors ABBVIE INC. (US) 2016-06-30 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-20160272630-A1 Bromodomain Inhibitors BRD4, BRDT, EP300 BRD4 1/4885BRD9 16/4885BRD7 13/4885
US-20160185769-A1 Bromodomain Inhibitors BRD1, BRD4, BRD3 BRD4 2/4885BRD9 26/4885BRD7 11/4885

“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.