SCHEMBL12070670

SCHEMBL12070670

COc1cc2c(cc1OC)C1=NCCN1C(c1cc(OC)c(OC)c(-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c1)=C2

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PTAFR P25105 18/20 0.58
▸ THRB P10828 1/20 0.41
▸ FYN P06241 1/20 0.41

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
SCHEMBL14927046 0.92 PTAFR (0.53) PTAFRTHRBFYN
SCHEMBL14926993 0.89 PTAFR (0.51) PTAFRTHRB
SCHEMBL14930719 0.83 FYN (0.40) PTAFRTHRBFYN
SCHEMBL14906859 0.82 PTAFR (0.45) PTAFRTHRBFYN
SCHEMBL14903973 0.73 PTAFR (0.40) PTAFRTHRBFYN
SCHEMBL9693418 0.73 PTAFR (1.00) PTAFR
SCHEMBL10618457 0.70 PTAFR (0.82) PTAFR
Hydrochloric Acid SCHEMBL10397113 0.69 PTAFR (0.81) PTAFR
Hydrochloric Acid SCHEMBL10396468 0.69 PTAFR (0.84) PTAFR
Hydrochloric Acid SCHEMBL9438229 0.69 PTAFR (0.98) PTAFR

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
US-8933096-B2 Antimicrobial agents Rugers, The State University of New Jersey (US) 2015-01-13 — — US disclosed
US-20130116278-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2013-05-09 — — US disclosed
WO-2011159926-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2011-12-22 — — WO disclosed
WO-2011156626-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2011-12-15 — — WO 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-20130116278-A1 ANTIMICROBIAL AGENTS MRPL21, ARG1, RPP30 PTAFR 3790/4885THRB 2893/4885FYN 3983/4885

“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.

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