SCHEMBL18538405

SCHEMBL18538405

CCS(=O)(=O)Nc1cc(-c2cc(C)c(=O)n(C)c2)cc2c1nc(C)n2Cc1ccc(F)cc1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 19/20 0.59
CREBBP Q92793 1/20 0.44

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
SCHEMBL18152876 0.92 BRD4 (0.50) BRD4
SCHEMBL22516862 0.92 BRD4 (0.69) BRD4CREBBP
SCHEMBL18152768 0.91 BRD4 (0.58) BRD4CREBBP
SCHEMBL18164311 0.90 BRD4 (0.55) BRD4CREBBP
SCHEMBL18541959 0.89 BRD4 (0.56) BRD4CREBBP
SCHEMBL18538433 0.86 BRD4 (0.55) BRD4
SCHEMBL23073121 0.86 BRD4 (0.48) BRD4
SCHEMBL18164198 0.84 BRD4 (0.47) BRD4
SCHEMBL23073126 0.84 BRD4 (0.47) BRD4
SCHEMBL18152893 0.84 BRD4 (0.54) BRD4CREBBP

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-20180134710-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2018-05-17 US disclosed
US-9908885-B2 Bromodomain inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-03-06 US disclosed
US-20170050968-A1 BROMODOMAIN INHIBITOR CELGENE QUANTICEL RESEARCH, INC. 2017-02-23 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-20170050968-A1 BROMODOMAIN INHIBITOR BRD3, BRPF3, EP300 BRD4 5/4885CREBBP 45/4885
US-20180134710-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 BRD4 5/4885CREBBP 45/4885

“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.