SCHEMBL683537

SCHEMBL683537

CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACE P12821 11/20 0.81
LMNA P02545 2/20 0.74
SMN1; SMN2 Q16637 1/20 0.68
MEN1 O00255 1/20 0.53
USP2 O75604 1/20 0.53
KMT2A Q03164 1/20 0.53
CYP3A4 P08684 1/20 0.53
ALOX15 P16050 1/20 0.53

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
SCHEMBL7266938 1.00 ACE (0.81) ACELMNASMN1; SMN2MEN1USP2
SCHEMBL9439053 0.96 ACE (0.76) ACELMNASMN1; SMN2MEN1USP2
Lisinopril Anhydrous SCHEMBL5411625 0.94 ACE (0.80) ACELMNASMN1; SMN2MEN1USP2
SCHEMBL683135 0.93 ACE (0.73) ACELMNASMN1; SMN2
SCHEMBL683090 0.92 ACE (0.69) ACELMNASMN1; SMN2MEN1USP2
SCHEMBL683530 0.91 ACE (0.64) ACELMNASMN1; SMN2
SCHEMBL9438818 0.90 ACE (0.77) ACELMNASMN1; SMN2
SCHEMBL683467 0.90 ACE (0.68) ACELMNASMN1; SMN2
SCHEMBL16380468 0.90 ACE (0.86) ACELMNASMN1; SMN2
Lisinopril Anhydrous SCHEMBL24062681 0.90 ACE (1.00) ACELMNASMN1; SMN2

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-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
US-4954158-A INHIBIT ETHYLENE PRODUCTION IN PLANTS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1990-09-04 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 4514/4885LMNA 3688/4885SMN1; SMN2 138/4885
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF ACE 6/4885LMNA 2155/4885SMN1; SMN2 907/4885

“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.