SCHEMBL3745563

SCHEMBL3745563

CCOC(=O)N1C2CCCC1CC(=O)C2

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.48
CHRM1 P11229 6/20 0.43
ALDH1A1 P00352 5/20 0.42
TSHR P16473 2/20 0.42
KMT2A Q03164 1/20 0.40
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
THRB P10828 1/20 0.37
ATM Q13315 1/20 0.37
GRM5 P41594 1/20 0.37

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
SCHEMBL1016674 0.93 CHRM1 (0.42) MAPK1CHRM1L3MBTL1CHRM4CHRM5
SCHEMBL15618675 0.93 CHRM1 (0.42) MAPK1CHRM1L3MBTL1CHRM4CHRM5
SCHEMBL29461904 0.86 MAPK1 (0.42) MAPK1CHRM1ALDH1A1TSHRKMT2A
SCHEMBL29822414 0.85 CHRM1 (0.49) CHRM1ALDH1A1TSHRL3MBTL1CHRM4
SCHEMBL17354962 0.83 CHRM1 (0.51) CHRM1ALDH1A1TSHRL3MBTL1CHRM4
SCHEMBL10063523 0.83 CHRM1 (0.51) CHRM1ALDH1A1TSHRL3MBTL1CHRM4
SCHEMBL13045376 0.83 ALDH1A1 (0.40) MAPK1CHRM1ALDH1A1TSHRKMT2A
SCHEMBL31694645 0.82 MAPK1 (0.52) MAPK1CHRM1ALDH1A1TSHRKMT2A
SCHEMBL20941849 0.82 MAPK1 (0.41) MAPK1CHRM1KMT2A
SCHEMBL20942090 0.81 KDM4E (0.37) MAPK1CHRM1ALDH1A1KMT2ACHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3638658-B1 PHARMACEUTICAL COMPOUNDS NXERA PHARMA UK LTD (GB) 2025-10-08 EP disclosed
EP-3119396-B1 MUSCARINIC RECEPTOR AGONISTS HEPTARES THERAPEUTICS LTD (GB) 2021-05-05 EP disclosed
US-10501483-B2 Enamines and diastereo-selective reduction of enamines ALLERGAN, INC. (US) 2019-12-10 US disclosed
US-20190119304-A1 ENAMINES AND DIASTEREO-SELECTIVE REDUCTION OF ENAMINES ALLERGAN, INC. 2019-04-25 US disclosed
US-8338450-B2 Compounds as dipeptidyl peptidase IV (DPP IV) inhibitors LUPIN LIMITED (IN) 2012-12-25 US disclosed
US-8338450-B2 Compounds as dipeptidyl peptidase IV (DPP IV) inhibitors LUPIN LIMITED (IN) 2012-12-25 US disclosed
US-8338450-B2 Compounds as dipeptidyl peptidase IV (DPP IV) inhibitors LUPIN LIMITED (IN) 2012-12-25 US disclosed
US-20100291020-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS LUPIN LIMITED (IN) 2010-11-18 US disclosed
US-20100291020-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS LUPIN LIMITED (IN) 2010-11-18 US disclosed
US-20100291020-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS LUPIN LIMITED (IN) 2010-11-18 US disclosed
US-20090118326-A1 Nicotinic Acetylcholine Receptor Modulators NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-05-07 US disclosed
WO-2009037719-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS LUPIN LIMITED (IN) 2009-03-26 WO disclosed
US-4277472-A 3,6-Disubstituted-5,7-(lower alkano)-5,6,7,8-tetrahydropyrido(4,3-C)pyridazines; their intermediates, preparation, antihypertensive use and compositions BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1981-07-07 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 (4 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-20100291020-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS DPP4, DPP7, DPP3 MAPK1 2974/4885CHRM1 4371/4885ALDH1A1 634/4885
US-10501483-B2 Enamines and diastereo-selective reduction of enamines ENY2, PNMT, CHRM1 MAPK1 1112/4885CHRM1 3/4885ALDH1A1 3481/4885
US-20090118326-A1 Nicotinic Acetylcholine Receptor Modulators CHRNA10, CHRNA6, CHRNA5 MAPK1 2090/4885CHRM1 18/4885ALDH1A1 963/4885
US-20190119304-A1 ENAMINES AND DIASTEREO-SELECTIVE REDUCTION OF ENAMINES ENY2, PNMT, CHRM1 MAPK1 1112/4885CHRM1 3/4885ALDH1A1 3481/4885

“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.