SCHEMBL538506

SCHEMBL538506

CC(C)C1(C(N)=O)CCCCC1.[LiH]

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL572320 0.98 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL573476 0.95 EPHX1 (0.33) ALDH1A1SMN1; SMN2LMNA
SCHEMBL8958541 0.95 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2LMNA
SCHEMBL8958407 0.95 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2LMNA
SCHEMBL23870287 0.95 EPHX1 (0.31) ALDH1A1SMN1; SMN2LMNA
SCHEMBL19280369 0.91 EPHX1 (0.31) LMNA
SCHEMBL4196047 0.85
SCHEMBL3121565 0.82 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2LMNA
SCHEMBL28425490 0.78 MME (0.33) ALDH1A1SMN1; SMN2LMNA
SCHEMBL14212132 0.77 EPHX1 (0.31) ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118994109-A Preparation method of lysine-specific demethylase 1 inhibitor 成都苑东生物制药股份有限公司 2024-11-22 CN claimed
CN-116463159-B Antioxidant additive, preparation method and application thereof 中国石油天然气股份有限公司 2024-07-23 CN claimed
CN-117720521-A Salt of nitrogen-containing heterocyclic ketone compound and preparation method thereof 江苏豪森药业集团有限公司 2024-03-19 CN claimed
CN-117447461-A Preparation method of pyrazoloheteroaryl derivative 苏州盛迪亚生物医药有限公司 2024-01-26 CN claimed
CN-116463159-A Antioxidant additive, preparation method and application thereof 中国石油天然气股份有限公司 2023-07-21 CN claimed
CN-111320542-B Antioxidant containing double hindered phenol structures and preparation method thereof 中国石油天然气股份有限公司 2023-04-25 CN claimed
CN-112552299-B Preparation method of linagliptin for treating type II diabetes 山东罗欣药业集团恒欣药业有限公司 2023-02-17 CN claimed
CN-111138413-B Preparation method of cyclin-dependent kinase inhibitor and intermediate thereof 江苏豪森药业集团有限公司 2022-11-04 CN claimed
US-11299455-B2 Process for diastereoselective synthesis of vicinal diamines PIRAMAL PHARMA LIMITED (IN) 2022-04-12 US claimed
US-20220073454-A1 AN IMPROVED PROCESS FOR DIASTEREOSELECTIVE SYNTHESIS OF VICINAL DIAMINES PIRAMAL PHARMA LIMITED (IN) 2022-03-10 US claimed
EP-0521686-A1 Stereoselective production of hydroxyamide compounds from chiral a-amino epoxides MERCK & CO. INC. (US) 1993-01-07 EP claimed
US-5169952-A Addition of metalated amide enolates to chiral alpha amino metalated epoxides MERCK & CO., INC. (US) 1992-12-08 US claimed
US-RE33495-E Stereoselective preparation of 3-substituted-4-anilino-piperidine compounds and derivatives BOC, INC. (US) 1990-12-18 US claimed
EP-0389551-A1 STEREOSELECTIVE PREPARATION OF 3-SUBSTITUTED-4-(PHENYL ANILO) PIPERIDINE COMPOUNDS AND DERIVATIVES BOC, INC. (US) 1990-10-03 EP claimed
US-4849521-A DEPROTONATION, ALKYLATION, REDUCTION BOC, INC. (US) 1989-07-18 US claimed
WO-1989004300-A1 STEREOSELECTIVE PREPARATION OF 3-SUBSTITUTED-4-(PHENYL ANILO) PIPERIDINE COMPOUNDS AND DERIVATIVES BOC, INC. (US) 1989-05-18 WO claimed
EP-0127429-B1 PROCESS FOR PREPARING OPTICALLY ACTIVE ((3-AMINO-3-CARBOXY)PROPYL-1) PHOSPHINIC ACID DERIVATIVES MEIJI SEIKA KAISHA LTD. (JP) 1989-04-19 EP claimed
US-4515950-A Process for the isomerization of ergovine derivatives SANDOZ LTD. (CH) 1985-05-07 US claimed
US-4499027-A REACTING A SHIFF'S BASE AND AN ALKYL VINYL PHOSPHINATE USING A BASIC CATALYST; HYDROLYSIS; STEREOSPECIFIC MEIJI SEIKA KAISHA, LTD. (JP) 1985-02-12 US claimed
EP-0127429-A2 Process for preparing optically active ((3-amino-3-carboxy)propyl-1) phosphinic acid derivatives MEIJI SEIKA KAISHA LTD. (JP) 1984-12-05 EP claimed

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-20220073454-A1 AN IMPROVED PROCESS FOR DIASTEREOSELECTIVE SYNTHESIS OF VICINAL DIAMINES AZI2, SAT1, TET2 ALDH1A1 1015/4885SMN1; SMN2 1677/4885LMNA 3977/4885
US-11299455-B2 Process for diastereoselective synthesis of vicinal diamines AZI2, SAT1, DNMT1 ALDH1A1 832/4885SMN1; SMN2 2248/4885LMNA 4037/4885

“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.