SCHEMBL683185

SCHEMBL683185

COC(=O)C1CSC(c2ccccc2O)N1C(=O)CCS

nearest known ligand 0.76

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.76
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
CYP2C19 P33261 2/20 0.43
CYP1A2 P05177 1/20 0.43
GFER P55789 1/20 0.42
CYP2C9 P11712 1/20 0.39
FFAR2 O15552 3/20 0.36
HTT P42858 1/20 0.36
GAA P10253 1/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TERT O14746 1/20 0.35

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
SCHEMBL683192 0.89 ACE (0.72) ACEMEN1KMT2AALDH1A1POLB
Rentiapril SCHEMBL30422754 0.86 ACE (1.00) ACEALDH1A1POLBFFAR2HTT
Rentiapril SCHEMBL11065900 0.86 ACE (1.00) ACEALDH1A1POLBFFAR2HTT
Rentiapril SCHEMBL294980 0.86 ACE (1.00) ACEALDH1A1POLBFFAR2HTT
Rentiapril SCHEMBL323403 0.86 ACE (1.00) ACEALDH1A1POLBFFAR2HTT
SCHEMBL10938561 0.85 ACE (0.77) ACEALDH1A1POLBFFAR2LMNA
SCHEMBL14367744 0.84 ACE (0.62) ACEMEN1KMT2AALDH1A1POLB
SCHEMBL683927 0.83 ACE (0.52) ACEMEN1KMT2AALDH1A1POLB
SCHEMBL683207 0.80 ACE (0.87) ACEALDH1A1POLBFFAR2HTT
SCHEMBL8654100 0.79 ACE (0.70) ACEALDH1A1POLBFFAR2HTT

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 4514/4885MEN1 3647/4885KMT2A 2044/4885
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF ACE 6/4885MEN1 1910/4885KMT2A 1893/4885

“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.