SCHEMBL16147192

SCHEMBL16147192

CCOc1nc(CC)c(CNC(=O)C(CC(C)C)SC(=O)CC)n1Cc1ccc(-c2ccccc2)cc1F

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 20/20 0.66
MME P08473 12/20 0.66
AGTR2 P50052 9/20 0.66
ECE1 P42892 1/20 0.66

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
SCHEMBL1257583 0.92 MME (0.79) AGTR1MMEAGTR2ECE1
SCHEMBL1257577 0.92 MME (0.79) AGTR1MMEAGTR2ECE1
SCHEMBL16146294 0.92 AGTR1 (0.66) AGTR1MMEAGTR2ECE1
SCHEMBL16147190 0.88 MME (0.56) AGTR1MMEAGTR2ECE1
SCHEMBL1099412 0.86 MME (0.81) AGTR1MMEAGTR2ECE1
SCHEMBL1258819 0.86 MME (0.81) AGTR1MMEAGTR2ECE1
SCHEMBL1099415 0.86 MME (0.81) AGTR1MMEAGTR2ECE1
SCHEMBL16146703 0.86 MME (0.69) AGTR1MMEAGTR2ECE1
SCHEMBL15121593 0.85 AGTR1 (0.66) AGTR1MMEAGTR2ECE1
SCHEMBL16147188 0.85 MME (0.58) AGTR1MMEAGTR2ECE1

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 2 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

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 AGTR1 1/4885MME 13/4885AGTR2 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.