SCHEMBL683637

SCHEMBL683637

O=C(O)C1CSC(c2ccc(O)cc2)N1C(=O)CCS

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 4/20 0.67
▸ GAA P10253 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.44
▸ TSHR P16473 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ FFAR2 O15552 3/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL11062771 1.00 ACE (0.67) ACEGAAPOLBRAB9AHSD17B10
SCHEMBL683641 0.90 ACE (0.73) ACEGAAPOLBRAB9AHSD17B10
SCHEMBL11190530 0.89 ACE (0.62) ACEGAAPOLBRAB9AHSD17B10
SCHEMBL11062272 0.86 ACE (0.66) ACEGAAPOLBRAB9AHSD17B10
SCHEMBL11186340 0.86 ACE (0.50) ACEGAAPOLBRAB9AHSD17B10
SCHEMBL11059109 0.85 ACE (0.65) ACEGAAPOLBRAB9AHSD17B10
SCHEMBL683176 0.85 ACE (0.58) ACEGAAPOLBRAB9AHSD17B10
SCHEMBL683282 0.85 GAA (0.70) ACEGAAPOLBRAB9AHSD17B10
SCHEMBL11385050 0.81 ACE (0.61) ACEGAAPOLBRAB9AHSD17B10
Rentiapril SCHEMBL294980 0.80 ACE (1.00) ACEPOLBHSD17B10FFAR2ALDH1A1

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 4514/4885GAA 1655/4885POLB 1250/4885
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF ACE 6/4885GAA 1899/4885POLB 1723/4885

“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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