SCHEMBL411887

SCHEMBL411887

CC(C)(N)C(O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 7/20 0.59
LMNA P02545 2/20 0.52
ADRA2A P08913 1/20 0.52
ADRA2C P18825 1/20 0.52
HIF1A Q16665 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.50
SLC6A4 P31645 2/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
RIPK1 Q13546 1/20 0.45

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
SCHEMBL26025745 1.00 AOC3 (0.59) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL9577935 0.84 AOC3 (0.57) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL10451736 0.80 AOC3 (0.53) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL6464699 0.80 AOC3 (0.57) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL112589 0.80 AOC3 (0.57) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL9334567 0.80 AOC3 (0.57) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL477440 0.80 AOC3 (0.57) AOC3LMNAADRA2AADRA2CHIF1A
SCHEMBL60356 0.79 AOC3 (0.57) AOC3LMNAKDM4EALDH1A1SLC6A4
SCHEMBL9683893 0.79 AOC3 (0.57) AOC3LMNAKDM4EALDH1A1SLC6A4
SCHEMBL8330705 0.79 AOC3 (0.52) AOC3LMNAADRA2AADRA2CHIF1A

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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1659154-B Process for the preparation of amine stereoisomers APSINTERM LLC 2012-05-30 CN claimed
EP-1497272-A4 METHOD OF PREPARING AMINE STEREOISOMERS APSINTERM LLC (US) 2007-02-07 EP claimed
US-7129378-B2 Method of preparing amine stereoisomers APSINTERM, LLC (US) 2006-10-31 US claimed
CN-1659154-A Process for the preparation of amine stereoisomers APSINTERM LLC (US) 2005-08-24 CN claimed
US-20050165240-A1 Method of preparing amine stereoisomers APSINTERM, LLC 2005-07-28 US claimed
EP-1497272-A2 METHOD OF PREPARING AMINE STEREOISOMERS Apsinterm, LLC. (US) 2005-01-19 EP claimed
WO-2003091207-A2 METHOD OF PREPARING AMINE STEREOISOMERS APSINTERM, LLC. (US) 2003-11-06 WO claimed
US-20250049036-A1 SUBSTITUTED FUSED BICYCLIC PYRIDINE CARBOXAMIDE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD. (IN) 2025-02-13 US disclosed
EP-4448494-A1 NOVEL SUBSTITUTED FUSED BICYCLIC PYRIDINE CARBOXAMIDE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI PI Industries Ltd. (IN) 2024-10-23 EP disclosed
EP-3541375-B1 FACTOR XIIA INHIBITORS MERCK SHARP & DOHME LLC (US) 2023-08-23 EP disclosed
WO-2023112056-A1 NOVEL SUBSTITUTED FUSED BICYCLIC PYRIDINE CARBOXAMIDE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD. (IN) 2023-06-22 WO disclosed
EP-3390355-B1 BENZENESULFONYL-ASYMMETRIC UREAS AND MEDICAL USES THEREOF HELSINN HEALTHCARE SA (CH) 2022-12-28 EP disclosed
CN-110088094-A The method for preparing the pure C9- acetal of alloisomerism 巴斯夫欧洲公司 2019-08-02 CN disclosed
CN-1659154-A Process for the preparation of amine stereoisomers APSINTERM LLC (US) 2005-08-24 CN disclosed
US-20050165240-A1 Method of preparing amine stereoisomers APSINTERM, LLC 2005-07-28 US disclosed
WO-2005037828-A1 NOVEL INHIBITORS OF DPP-IV, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT LG LIFE SCIENCES LTD. (KR) 2005-04-28 WO disclosed
EP-1497272-A2 METHOD OF PREPARING AMINE STEREOISOMERS Apsinterm, LLC. (US) 2005-01-19 EP disclosed
WO-2003091207-A2 METHOD OF PREPARING AMINE STEREOISOMERS APSINTERM, LLC. (US) 2003-11-06 WO disclosed
US-5367094-A Hydrogenation for dehydroxylation of 2-amino-1-phenyl-1,3-propanediol in the presence of strong acid YUKONG, LTD. (KR) 1994-11-22 US disclosed
US-4261890-A Substituted tetrahydrobenzazepines and tetrahydronaphthazepines and methods for their production WARNER-LAMBERT COMPANY (US) 1981-04-14 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 (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-20250049036-A1 SUBSTITUTED FUSED BICYCLIC PYRIDINE CARBOXAMIDE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CBR3, C5, CBR1 AOC3 2227/4885LMNA 3367/4885ADRA2A 2890/4885
US-20050165240-A1 Method of preparing amine stereoisomers SRM, TST, SMOX AOC3 353/4885LMNA 3417/4885ADRA2A 894/4885

“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.