SCHEMBL683641

SCHEMBL683641

O=C(O)C1CSC(c2ccccc2)N1C(=O)CCS

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 5/20 0.73
▸ HSD17B10 Q99714 1/20 0.55
▸ FFAR2 O15552 4/20 0.48
▸ POLB P06746 2/20 0.48
▸ GAA P10253 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ LMNA P02545 1/20 0.42

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
SCHEMBL11385050 0.92 ACE (0.61) ACEHSD17B10FFAR2POLBGAA
SCHEMBL683637 0.90 ACE (0.67) ACEHSD17B10FFAR2POLBGAA
SCHEMBL11062771 0.90 ACE (0.67) ACEHSD17B10FFAR2POLBGAA
SCHEMBL11190530 0.88 ACE (0.62) ACEHSD17B10FFAR2POLBGAA
SCHEMBL11059109 0.88 ACE (0.65) ACEHSD17B10FFAR2POLBGAA
SCHEMBL10939993 0.88 ACE (0.57) ACEHSD17B10FFAR2POLBGAA
SCHEMBL11257852 0.85 ACE (0.55) ACEHSD17B10FFAR2POLBGAA
SCHEMBL683282 0.85 GAA (0.70) ACEHSD17B10FFAR2POLBGAA
SCHEMBL683176 0.85 ACE (0.58) ACEHSD17B10FFAR2POLBGAA
Rentiapril SCHEMBL294980 0.85 ACE (1.00) ACEHSD17B10FFAR2POLBALDH1A1

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-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 — — US disclosed
US-20110046090-A1 MODULATION OF NEUROGENESIS WITH GABA AGENTS AND GABA ANALOGS BRAINCELLS INC. (US) 2011-02-24 — — US disclosed
US-20110046090-A1 MODULATION OF NEUROGENESIS WITH GABA AGENTS AND GABA ANALOGS BRAINCELLS INC. (US) 2011-02-24 — — 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-20110046090-A1 MODULATION OF NEUROGENESIS WITH GABA AGENTS AND GABA ANALOGS GAP43, GABRB1, GABRB3 ACE 4514/4885HSD17B10 3423/4885FFAR2 1345/4885
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF ACE 6/4885HSD17B10 2865/4885FFAR2 2651/4885

“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.

Send feedback