SCHEMBL683797

SCHEMBL683797

COC(=O)[C@@H]1CCCN1C(=O)CS

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
FKBP1A P62942 2/20 0.50
ALDH1A1 P00352 2/20 0.48
LMNA P02545 2/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PKM P14618 1/20 0.48
PEPD P12955 2/20 0.47
XPNPEP1 Q9NQW7 1/20 0.44
ACE P12821 3/20 0.44
CYP2C19 P33261 1/20 0.42
HSD17B10 Q99714 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
SCHEMBL683441 0.87 LMNA (0.52) POLBFKBP1AALDH1A1LMNARAB9A
SCHEMBL7333530 0.85 POLB (0.54) POLBFKBP1AALDH1A1LMNARAB9A
SCHEMBL4179454 0.85 FKBP1A (0.55) POLBFKBP1AALDH1A1LMNARAB9A
SCHEMBL13662643 0.85 FKBP1A (0.55) POLBFKBP1AALDH1A1LMNARAB9A
SCHEMBL7333522 0.85 POLB (0.54) POLBFKBP1AALDH1A1LMNARAB9A
SCHEMBL683098 0.84 FKBP1A (0.53) FKBP1AALDH1A1LMNARAB9ASMN1; SMN2
SCHEMBL23135776 0.83 ALDH1A1 (0.54) POLBFKBP1AALDH1A1LMNARAB9A
SCHEMBL2606998 0.83 ALDH1A1 (0.54) POLBFKBP1AALDH1A1LMNARAB9A
SCHEMBL4437850 0.83 POLB (0.52) POLBFKBP1AALDH1A1LMNARAB9A
SCHEMBL8248348 0.83 POLB (0.52) POLBFKBP1AALDH1A1LMNARAB9A

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 POLB 1250/4885FKBP1A 1039/4885ALDH1A1 1041/4885
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF POLB 1723/4885FKBP1A 1111/4885ALDH1A1 1565/4885

“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.