SCHEMBL4941260

SCHEMBL4941260

CC(C)(C)N(CN1CCC[C@@H]1CNC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PREP P48147 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 1/20 0.42
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
FKBP1A P62942 1/20 0.41
HTR1A P08908 2/20 0.41

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
SCHEMBL3603880 0.80 PREP (0.49) PREPSMN1; SMN2RAB9AALDH1A1DRD2
SCHEMBL13166438 0.78 ALDH1A1 (0.51) PREPSMN1; SMN2RAB9AALDH1A1DRD2
SCHEMBL13316351 0.78 ALDH1A1 (0.51) PREPSMN1; SMN2RAB9AALDH1A1DRD2
SCHEMBL336766 0.76 OPRD1 (0.53) PREPFKBP1A
SCHEMBL4738328 0.76 OPRD1 (0.53) PREPFKBP1A
SCHEMBL337363 0.76 OPRD1 (0.53) PREPFKBP1A
SCHEMBL25186706 0.76 PREP (0.57) PREPSMN1; SMN2ALDH1A1FKBP1A
SCHEMBL3336958 0.76 PREP (0.57) PREPSMN1; SMN2ALDH1A1FKBP1A
SCHEMBL3342656 0.76 PREP (0.57) PREPSMN1; SMN2ALDH1A1FKBP1A
SCHEMBL25766824 0.74 PREP (0.44) PREPSMN1; SMN2RAB9ADRD2DRD3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080269208-A1 Pyridine Derivatives and Their Use in the Treatment of Psychotic Disorders KaNDy Therapeutics Limited (GB) 2008-10-30 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 (1 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-20080269208-A1 Pyridine Derivatives and Their Use in the Treatment of Psychotic Disorders SLC6A3, NDUFS5, NDUFB6 PREP 1477/4885SMN1; SMN2 2090/4885RAB9A 1086/4885

“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.