SCHEMBL28501010

SCHEMBL28501010

CCOC(=O)[C@@H]1CC12CCN(S(N)(=O)=O)CC2

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 2/20 0.38
TP53 P04637 2/20 0.38
PKM P14618 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 5/20 0.38
POLB P06746 2/20 0.37
MAPT P10636 3/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
LMNA P02545 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HTT P42858 2/20 0.34

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
SCHEMBL15721207 0.81 OPRM1 (0.42) CYP3A4CYP2C19MAPTCYP2D6CYP2C9
SCHEMBL8171686 0.80 MAPT (0.39) CYP3A4CYP2C19ALDH1A1POLBMAPT
SCHEMBL2796930 0.79 MAPT (0.41) CYP3A4CYP2C19ALDH1A1POLBMAPT
SCHEMBL14725161 0.78 HRH3 (0.47) CYP3A4CYP2C19NPSR1ALDH1A1MAPT
SCHEMBL1634121 0.77 ALDH1A1 (0.46) CYP3A4CYP2C19ALDH1A1POLBMAPT
SCHEMBL16369922 0.77 ALDH1A1 (0.43) CYP3A4CYP2C19ALDH1A1POLBMAPT
SCHEMBL23062936 0.77 ALDH1A1 (0.37) SMN1; SMN2CYP3A4CYP2C19TP53PKM
SCHEMBL22616044 0.76 CHRNA7 (0.36) CYP2C19ALDH1A1KMT2AMEN1TSHR
SCHEMBL1635627 0.76 ALDH1A1 (0.49) CYP3A4CYP2C19ALDH1A1MAPTKMT2A
SCHEMBL1634763 0.76 ALDH1A1 (0.49) CYP3A4CYP2C19ALDH1A1MAPTKMT2A

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-12534458-B2 Spiropiperidine allosteric modulators of nicotinic acetylcholine receptors MERCK SHARP & DOHME LLC (US) 2026-01-27 US disclosed
US-12331022-B2 Spiropiperidine allosteric modulators of nicotinic acetylcholine receptors MERCK SHARP & DOHME LLC (US) 2025-06-17 US disclosed
CN-112119076-B Spiropiperidine allosteric modulators of nicotinic acetylcholine receptors 默沙东有限责任公司 2025-01-10 CN disclosed
EP-3788043-B1 SPIROPIPERIDINE ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS MERCK SHARP & DOHME LLC (US) 2024-11-06 EP disclosed
US-20220396571-A1 SPIROPIPERIDINE ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS MERCK SHARP & DOHME CORP. (US) 2022-12-15 US disclosed
US-11332463-B2 Spiropiperidine allosteric modulators of nicotinic acetylcholine receptors MERCK SHARP & DOHME CORP. (US) 2022-05-17 US disclosed
US-20220119351-A1 SPIROPIPERIDINE ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS MERCK SHARP & DOHME CORP. (US) 2022-04-21 US disclosed
CN-112119076-A Spiropiperidine allosteric modulators of nicotinic acetylcholine receptors 默沙东公司 2020-12-22 CN 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 (5 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-12331022-B2 Spiropiperidine allosteric modulators of nicotinic acetylcholine receptors CHRNA7, CHRNA5, CHRNA2 SMN1; SMN2 2484/4885CYP3A4 2610/4885CYP2C19 3339/4885
US-12534458-B2 Spiropiperidine allosteric modulators of nicotinic acetylcholine receptors CHRNA6, CHRNA7, CHRNA5 SMN1; SMN2 2340/4885CYP3A4 1778/4885CYP2C19 2996/4885
US-11332463-B2 Spiropiperidine allosteric modulators of nicotinic acetylcholine receptors CHRNA7, CHRNA5, CHRNA6 SMN1; SMN2 2483/4885CYP3A4 2192/4885CYP2C19 2717/4885
US-20220396571-A1 SPIROPIPERIDINE ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS CHRNA7, CHRNA5, CHRNA6 SMN1; SMN2 2546/4885CYP3A4 2095/4885CYP2C19 2800/4885
US-20220119351-A1 SPIROPIPERIDINE ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS CHRNA7, CHRNA5, CHRNA2 SMN1; SMN2 2686/4885CYP3A4 1879/4885CYP2C19 2353/4885

“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.