SCHEMBL13403259

SCHEMBL13403259

CN1CCCCCC1C(O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 2/20 0.49
CHRNA3 P32297 2/20 0.49
CHRM3 P20309 2/20 0.47
SLC6A9 P48067 2/20 0.44
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43

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
SCHEMBL1797592 0.98 CHRNB4 (0.50) CHRNB4CHRNA3CHRM3SLC6A9CARM1
SCHEMBL6819282 0.98 CHRNB4 (0.50) CHRNB4CHRNA3CHRM3SLC6A9CARM1
SCHEMBL1797593 0.98 CHRNB4 (0.50) CHRNB4CHRNA3CHRM3SLC6A9CARM1
SCHEMBL6648223 0.93 CHRNB4 (0.55) CHRNB4CHRNA3CHRM3CARM1PRMT6
SCHEMBL4781411 0.89 CHRNB4 (0.46) CHRNB4CHRNA3SLC6A2SLC6A4SLC6A3
SCHEMBL4725436 0.89 CHRNB4 (0.46) CHRNB4CHRNA3SLC6A2SLC6A4SLC6A3
SCHEMBL4725442 0.89 CHRNB4 (0.46) CHRNB4CHRNA3SLC6A2SLC6A4SLC6A3
SCHEMBL6839407 0.84 SLC6A3 (0.43) CHRNB4CHRNA3SLC6A2SLC6A4SLC6A3
SCHEMBL4780734 0.84 SLC6A2 (0.43) CHRNB4CHRNA3SLC6A2SLC6A4SLC6A3
SCHEMBL4780731 0.84 SLC6A2 (0.43) CHRNB4CHRNA3SLC6A2SLC6A4SLC6A3

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-7700585-B2 Derivatives of N-[phenyl(pyrrolidine-2-YL)methyl]benzamide and N-[(azepan-2-YL) phenylmethyl]benzamide, preparation method thereof and application of same in therapeutics SANOFI-AVENTIS (FR) 2010-04-20 US disclosed
US-20070208006-A1 DERIVATIVES OF N-[PHENYL(PYRROLIDINE-2-YL)METHYL]BENZAMIDE AND N-[(AZEPAN-2-YL)PHENYLMETHYL]BENZAMIDE, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2007-09-06 US disclosed
US-7226917-B2 Derivatives of N-[phenyl(pyrrolidine-2-yl)methyl]benzamide and N-[(azepan-2-yl)phenylmethyl]benzamide, preparation, and use in treatment of schizophrenia SANOFI-AVENTIS (FR) 2007-06-05 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-20070208006-A1 DERIVATIVES OF N-[PHENYL(PYRROLIDINE-2-YL)METHYL]BENZAMIDE AND N-[(AZEPAN-2-YL)PHENYLMETHYL]BENZAMIDE, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SNCA, CHRNA10, CHRNA5 CHRNB4 71/4885CHRNA3 21/4885CHRM3 277/4885

“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.