SCHEMBL22730504

SCHEMBL22730504

Cc1cccc(C)c1Oc1cccc(-c2c(C)nnn2C2CCNCC2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 1.00

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
SCHEMBL22730448 0.85 BRD4 (1.00) BRD4
SCHEMBL22730549 0.83 BRD4 (1.00) BRD4
SCHEMBL22730373 0.83 BRD4 (1.00) BRD4
SCHEMBL22730479 0.83 BRD4 (0.76) BRD4
SCHEMBL22730482 0.82 BRD4 (1.00) BRD4
SCHEMBL22730300 0.82 BRD4 (1.00) BRD4
SCHEMBL22730547 0.81 BRD4 (1.00) BRD4
SCHEMBL22730500 0.81 BRD4 (1.00) BRD4
SCHEMBL22730460 0.81 BRD4 (1.00) BRD4
SCHEMBL22730503 0.81 BRD4 (0.71) BRD4

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
US-20200377474-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2020-12-03 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 (1 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-20200377474-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF BRDT, BRD4, BRD3 BRD4 2/4885

“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.