SCHEMBL186279

SCHEMBL186279

NC(c1ccccc1)C(O)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.65
KDM4E B2RXH2 2/20 0.62
ADRA2A P08913 1/20 0.62
ADRA2C P18825 1/20 0.62
LMNA P02545 1/20 0.62
HIF1A Q16665 1/20 0.62
ALDH1A1 P00352 2/20 0.60
AOC3 Q16853 6/20 0.52
F2 P00734 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50
SLC6A3 Q01959 1/20 0.50
CHRM2 P08172 1/20 0.46
ADRA1A P35348 1/20 0.46

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
SCHEMBL82461 1.00 DPP4 (0.65) DPP4KDM4EADRA2AADRA2CLMNA
SCHEMBL2438955 1.00 DPP4 (0.65) DPP4KDM4EADRA2AADRA2CLMNA
SCHEMBL2763479 1.00 DPP4 (0.65) DPP4KDM4EADRA2AADRA2CLMNA
SCHEMBL3802461 1.00 DPP4 (0.65) DPP4KDM4EADRA2AADRA2CLMNA
SCHEMBL82462 1.00 DPP4 (0.65) DPP4KDM4EADRA2AADRA2CLMNA
SCHEMBL17514076 1.00 DPP4 (0.65) DPP4KDM4EADRA2AADRA2CLMNA
SCHEMBL14959742 1.00 DPP4 (0.65) DPP4KDM4EADRA2AADRA2CLMNA
SCHEMBL1131702 1.00 DPP4 (0.65) DPP4KDM4EADRA2AADRA2CLMNA
SCHEMBL8120379 0.89 DPP4 (0.52) DPP4KDM4EADRA2AADRA2CLMNA
Alcohol SCHEMBL8325116 0.89 KDM4E (0.57) DPP4KDM4EADRA2AADRA2CLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025104679-A1 PROCESSES FOR MAKING INTERMEDIATES FOR ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2025-05-22 WO claimed
EP-3694864-B1 BORONIC ACID DERIVATIVES AND SYNTHESIS THEREOF QPEX BIOPHARMA INC (US) 2025-03-05 EP claimed
CN-117447462-A Chiral triazole-oxazoline compound and preparation method and application thereof 吉林大学 2024-01-26 CN claimed
CN-117399070-A Chiral metal synergistic catalytic system containing chelating ligand and application of chiral metal synergistic catalytic system in asymmetric synthesis of bedaquiline 上海交通大学 2024-01-16 CN claimed
US-20230416252-A1 PROCESS TOWARD THE MANUFACTURE OF (6R,10S)-10-{4-[5-CHLORO-2-(4-CHLORO-1H-1,2,3-TRIAZOL-1-YL)PHENYL]-6-OXO-1(6H)-PYRIMIDINYL}- 1-(DIFLUOROMETHYL)-6-METHYL-1,4,7,8,9,10-HEXAHYDRO-11,15-(METHENO)PYRAZOLO[4,3-B][1,7]DIAZACYCLOTETRADECIN-5(6H)-ONE JANSSEN PHARMACEUTICA NV (BE) 2023-12-28 US claimed
CN-117120418-A Process for the preparation of compound (I) 百时美施贵宝公司 2023-11-24 CN claimed
CN-116899502-A Method for preparing bedaquiline by low-temperature continuous flow and prepared product 上海交通大学 2023-10-20 CN claimed
CN-116685322-A Method for synthesizing substituted pyridone-pyridyl compounds 阿克拉瑞斯治疗股份有限公司 2023-09-01 CN claimed
EP-4225757-A1 A PROCESS TOWARD THE MANUFACTURE OF (6R,10S)-10-{4-[5-CHLORO-2-(4-CHLORO-1H-1,2,3-TRIAZOL-1-YL)PHENYL]-6-OXO-1(6H)-PYRIMIDINYL}-1-(DIFLUOROMETHYL)-6-METHYL-1,4,7,8,9,10-HEXAHYDRO-11,15-(METHENO)PYRAZOLO[4,3-B] [1,7]DIAZACYCLOTETRADECIN-5(6H)-ONE Bristol-Myers Squibb Company (US) 2023-08-16 EP claimed
CN-115465853-B Orange light carbon dot based on citric acid and chiral 2-amino-1, 2-diphenyl ethanol and preparation method and application thereof 西华大学 2023-06-20 CN claimed
CN-1087348-C Pacemate separation of primary and secondary heteroatom-substituted amine by enzyme-catalysed acylation BASF AG (DE) 2002-07-10 CN claimed
US-20020058788-A1 Facile deprotection of Fmoc protected amino groups DISCOVERY PARTNERS INTERNATIONAL, INC. 2002-05-16 US claimed
EP-0844230-A2 Optical resolution method of (plus, minus)-3,4-dihydroxybutanoic acid KURARAY CO., LTD. (JP) 1998-05-27 EP claimed
EP-0708764-A1 ENANTHIOSELECTIVE PREPARATION OF THIAZOLE DERIVATIVES PFIZER INC. (US) 1996-05-01 EP claimed
EP-0485069-B1 Process for producing optically active amines SUMITOMO CHEMICAL CO (JP) 1995-02-15 EP claimed
WO-1995002585-A1 ENANTHIOSELECTIVE PREPARATION OF THIAZOLE DERIVATIVES PFIZER INC. (US) 1995-01-26 WO claimed
US-5200561-A PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-04-06 US claimed
EP-0485069-A1 Process for producing optically active amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-05-13 EP claimed
EP-0085023-A1 Process for the separation of enantiomers by partition between liquid phases CIBA-GEIGY AG (CH) 1983-08-03 EP claimed
US-3988456-A ANALGESICS, ANTITUSSIVE DAINIPPON PHARMACEUTICAL CO., LTD. (JA) 1976-10-26 US 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-20020058788-A1 Facile deprotection of Fmoc protected amino groups DNPEP, LNPEP, NPEPPS DPP4 315/4885KDM4E 1101/4885ADRA2A 4540/4885
US-20230416252-A1 PROCESS TOWARD THE MANUFACTURE OF (6R,10S)-10-{4-[5-CHLORO-2-(4-CHLORO-1H-1,2,3-TRIAZOL-1-YL)PHENYL]-6-OXO-1(6H)-PYRIMIDINYL}- 1-(DIFLUOROMETHYL)-6-METHYL-1,4,7,8,9,10-HEXAHYDRO-11,15-(METHENO)PYRAZOLO[4,3-B][1,7]DIAZACYCLOTETRADECIN-5(6H)-ONE CYP1B1, AZI2, TET1 DPP4 370/4885KDM4E 689/4885ADRA2A 3439/4885

“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.