SCHEMBL385325

SCHEMBL385325

C[C@H]1CN(Cc2ccccc2)CCC1=O

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 6/20 0.62
LMNA P02545 2/20 0.62
ACHE P22303 2/20 0.51
SIGMAR1 Q99720 2/20 0.49
GRIN1 Q05586 1/20 0.49
GRIN2B Q13224 1/20 0.49
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MC4R P32245 1/20 0.46
GAA P10253 1/20 0.45
POLB P06746 1/20 0.45
BCHE P06276 1/20 0.44
BACE1 P56817 1/20 0.44

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
SCHEMBL6943959 1.00 TACR1 (0.62) TACR1LMNAACHESIGMAR1GRIN1
SCHEMBL467266 1.00 TACR1 (0.62) TACR1LMNAACHESIGMAR1GRIN1
Hydrochloric Acid SCHEMBL10382846 0.98 LMNA (0.64) TACR1LMNAACHESIGMAR1GRIN1
Iodide SCHEMBL8816299 0.98 TACR1 (0.61) TACR1LMNAACHESIGMAR1GRIN1
SCHEMBL20274753 0.86 ACHE (0.63) TACR1ACHESIGMAR1MC4RBCHE
SCHEMBL9466471 0.84 ACHE (0.54) TACR1LMNAACHESIGMAR1
SCHEMBL9379752 0.83 ACHE (0.50) TACR1LMNAACHESIGMAR1MC4R
SCHEMBL6230149 0.82 LMNA (0.46) TACR1LMNAACHEBCHE
SCHEMBL31193852 0.81 TACR1 (0.59) TACR1LMNAACHESIGMAR1GRIN1
SCHEMBL1339508 0.81 TACR1 (0.59) TACR1LMNAACHESIGMAR1GRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3724162-B1 INTERMEDIATES FOR OPTICALLY ACTIVE PIPERIDINE DERIVATIVES AND PREPARATION METHODS THEREOF HK INNO N CORP (KR) 2023-10-11 EP claimed
CN-115010652-A Synthesis process of piperidine derivative intermediate 苏州诚和医药化学有限公司 2022-09-06 CN claimed
CN-111587240-B Intermediate of optically active piperidine derivative and process for producing the same 怡诺安有限公司 2023-09-01 CN disclosed
CN-115010652-A Synthesis process of piperidine derivative intermediate 苏州诚和医药化学有限公司 2022-09-06 CN disclosed
CN-115010652-A Synthesis process of piperidine derivative intermediate 苏州诚和医药化学有限公司 2022-09-06 CN disclosed
CN-111587240-A Intermediate of optically active piperidine derivative and process for producing the same 怡诺安有限公司 2020-08-25 CN disclosed
US-RE45364-E1 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2015-02-03 US disclosed
EP-1731518-B1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO (JP) 2014-06-25 EP disclosed
EP-2650290-A1 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2013-10-16 EP disclosed
US-8101768-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2012-01-24 US disclosed
EP-2367830-A1 1-OXA-8-AZASPIRO [4, 5] DECANE- 8 -CARBOXAMIDE COMPOUNDS AS FAAH INHIBITORS Pfizer Inc. (US) 2011-09-28 EP disclosed
EP-1056744-B1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMA INC (US) 2003-10-22 EP disclosed
US-20030176461-A1 Aminopiperidines NPS ALLELIX CORP. (CANADA CORPORATION) (CA) 2003-09-18 US disclosed
US-20030105098-A1 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines AVENTISUB II INC. 2003-06-05 US disclosed
EP-0863875-B1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY HOFFMANN LA ROCHE (CH) 2003-06-04 EP disclosed
EP-1296950-A2 AMINOPIPERIDINES FOR USE AS GLYT-1 INHIBITORS NPS Allelix Corp. (CA) 2003-04-02 EP disclosed
US-6479487-B1 INHIBIT CYCLIN DEPENDENT KINASES, PARTICULARLY CDK-2; ANTIAPOPTOSIS AGENT; INHIBITS DEVELOPMENT OF NEOPLASMS AVENTIS PHARMACEUTICALS INC. 2002-11-12 US disclosed
WO-2001081308-A2 AMINOPIPERIDINES FOR USE AS GLYT-1 INHIBITORS NPS ALLELIX CORP. (CA) 2001-11-01 WO disclosed
US-6150526-A Piperidine derivative having renin inhibiting activity HOFFMANN-LA ROCHE INC. (US) 2000-11-21 US disclosed
US-6051712-A PREVENTION OF HIGH BLOOD PRESSURE AND CARDIAC INSUFFICIENCY, AS WELL AS GLAUCOMA, CARDIAC INFARCT, KIDNEY INSUFFICIENCY AND RESTENOSIS HOFFMANN-LA ROCHE INC. (US) 2000-04-18 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-20030105098-A1 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines CDK6, CDK5, CDK2 TACR1 3658/4885LMNA 2388/4885ACHE 3357/4885
US-20030176461-A1 Aminopiperidines SLC1A2, SLC6A4, SLC1A1 TACR1 324/4885LMNA 2941/4885ACHE 826/4885

“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.