SCHEMBL3852094

SCHEMBL3852094

N[C@H](c1ccccc1)[C@H](NS(=O)(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.51
SLC1A3 P43003 3/20 0.50
SLC1A2 P43004 3/20 0.50
SLC1A1 P43005 3/20 0.50
MMP2 P08253 2/20 0.46
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
DPP4 P27487 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 3/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MMP1 P03956 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
CYP1A2 P05177 3/20 0.41
CYP2C9 P11712 3/20 0.41
CYP2C19 P33261 3/20 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
SCHEMBL3862569 1.00 GBA1 (0.51) GBA1SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL2067895 1.00 GBA1 (0.51) GBA1SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL7089076 0.98 GBA1 (0.50) GBA1SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL13191678 0.90 SLC1A3 (0.50) GBA1SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL7618209 0.89 SLC1A3 (0.51) GBA1SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL2239236 0.89 ALDH1A1 (0.53) GBA1SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL15841411 0.89 SLC1A3 (0.51) SLC1A3SLC1A2SLC1A1MMP2CA12
SCHEMBL292958 0.89 ALDH1A1 (0.53) GBA1SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL15841410 0.89 SLC1A3 (0.51) SLC1A3SLC1A2SLC1A1MMP2CA12
SCHEMBL130104 0.89 ALDH1A1 (0.53) GBA1SLC1A3SLC1A2SLC1A1MMP2

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
CN-119775208-A Chiral bisimidazoline ligand containing cyclohexane skeleton structure and preparation method thereof 北京化工大学 2025-04-08 CN disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-20060069098-A1 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2006-03-30 US disclosed
EP-1300381-B1 Process for preparing optically active alcohols JAPAN SCIENCE & TECH AGENCY (JP) 2006-03-08 EP disclosed
US-6642387-B2 Dehalogenation esterification; efficient; no toxic materials KANEKA CORPORATION (JP) 2003-11-04 US disclosed
US-20030130521-A1 Substituted acetylpyridine derivatives and process for the preparation of intermediates for optically active beta3 agonist by the use of the same KANEKA CORPORATION (JP) 2003-07-10 US disclosed
US-6515134-B1 A production method of an optically active hydroxyethyl pyridine derivative represented by the general formula which comprises using a microorganism-derived carbonyl reducing enzyme or a culture of a microorganism having an ability of KANEKA CORPORATION (JP) 2003-02-04 US disclosed
EP-1153919-A1 SUBSTITUTED ACETYLPYRIDINE DERIVATIVES AND PROCESS FOR THE PREPARATION OF INTERMEDIATES FOR OPTICALLY ACTIVE BETA3 AGONIST BY THE USE OF THE SAME KANEKA CORPORATION (JP) 2001-11-14 EP 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-20030130521-A1 Substituted acetylpyridine derivatives and process for the preparation of intermediates for optically active beta3 agonist by the use of the same ADRB3, ADRB2, ADRB1 GBA1 1542/4885SLC1A3 1594/4885SLC1A2 2062/4885
US-20060069098-A1 Bicyclic compound CRH, NR3C2, CRHR1 GBA1 4575/4885SLC1A3 930/4885SLC1A2 495/4885

“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.