SCHEMBL3535375

SCHEMBL3535375

CN1CCCC1C(NC(=O)c1cccc(C(F)(F)F)c1Cl)c1ccccc1

nearest known ligand 0.94

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 15/20 0.94
CTSS P25774 3/20 0.50
CTSK P43235 2/20 0.48
P2RX7 Q99572 1/20 0.48

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
SCHEMBL1689575 1.00 SLC6A9 (0.94) SLC6A9CTSSCTSKP2RX7
Hydrochloric Acid SCHEMBL3534258 0.99 SLC6A9 (0.93) SLC6A9CTSSCTSKP2RX7
SCHEMBL4245201 0.97 SLC6A9 (1.00) SLC6A9CTSSCTSKP2RX7
SCHEMBL4589446 0.97 SLC6A9 (1.00) SLC6A9CTSSCTSKP2RX7
SCHEMBL4245203 0.97 SLC6A9 (1.00) SLC6A9CTSSCTSKP2RX7
SCHEMBL3533390 0.96 SLC6A9 (0.98) SLC6A9CTSSCTSKP2RX7
SCHEMBL1689574 0.96 SLC6A9 (0.98) SLC6A9CTSSCTSKP2RX7
Hydrochloric Acid SCHEMBL4588406 0.96 SLC6A9 (0.98) SLC6A9CTSSCTSKP2RX7
Hydrochloric Acid SCHEMBL4588412 0.96 SLC6A9 (0.98) SLC6A9CTSSCTSKP2RX7
Hydrochloric Acid SCHEMBL3533471 0.95 SLC6A9 (0.96) SLC6A9CTSSCTSKP2RX7

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 8 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 claimed
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
EP-1680400-B1 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) 2007-06-06 EP 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
US-20060223802-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) 2006-10-05 US disclosed
EP-1680400-A2 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) 2006-07-19 EP disclosed
WO-2005037785-A2 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) 2005-04-28 WO 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-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 SLC6A9 3907/4885CTSS 621/4885CTSK 1399/4885
US-20060223802-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 SLC6A9 3907/4885CTSS 621/4885CTSK 1399/4885

“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.