SCHEMBL3662034

SCHEMBL3662034

CCCCc1nc(Cl)c(CNC(=O)C(C)CC(C)CS)n1Cc1ccc(-c2ccccc2C(=O)OC)cc1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MME P08473 18/20 0.70
AGTR1 P30556 18/20 0.70

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
SCHEMBL1258013 0.90 MME (0.86) MMEAGTR1
SCHEMBL1258011 0.90 MME (0.86) MMEAGTR1
SCHEMBL462 0.82 AGTR2 (0.80) AGTR1
SCHEMBL1256561 0.82 MME (1.00) MMEAGTR1
SCHEMBL1256557 0.82 MME (1.00) MMEAGTR1
SCHEMBL8792660 0.82 AGTR2 (0.70) AGTR1
SCHEMBL883 0.81 AGTR1 (0.69) AGTR1
SCHEMBL734 0.81 AGTR2 (0.69) AGTR1
Hydrochloric Acid SCHEMBL484 0.81 AGTR2 (0.69) AGTR1
SCHEMBL1256409 0.81 MME (1.00) MMEAGTR1

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-9012485-B2 Dual-acting imidazole antihypertensive agents THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-04-21 US disclosed
US-20140303222-A1 DUAL-ACTING IMIDAZOLE ANTIHYPERTENSIVE AGENTS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2014-10-09 US disclosed
EP-2146963-A2 DUAL-ACTING ANTIHYPERTENSIVE AGENTS Theravance, Inc. (US) 2010-01-27 EP disclosed
WO-2008133896-A2 DUAL-ACTING ANTIHYPERTENSIVE AGENTS THERAVANCE, INC. (US) 2008-11-06 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-20140303222-A1 DUAL-ACTING IMIDAZOLE ANTIHYPERTENSIVE AGENTS AGTR1, AGTR2, REN MME 13/4885AGTR1 1/4885

“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.