SCHEMBL851654

SCHEMBL851654

N[C@H](c1ccccc1)[C@H](N)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 1.00
F2 P00734 1/20 0.65
HTR2A P28223 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
ADRA2A P08913 1/20 0.48
ADRA2C P18825 1/20 0.48
LMNA P02545 1/20 0.48
HIF1A Q16665 1/20 0.48
KDM4E B2RXH2 1/20 0.48
TSHR P16473 1/20 0.47
ALDH1A1 P00352 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
SCHEMBL1878642 1.00 DPP4 (1.00) DPP4F2HTR2ATAAR1ADRA2A
SCHEMBL2067094 1.00 DPP4 (1.00) DPP4F2HTR2ATAAR1ADRA2A
SCHEMBL644767 1.00 DPP4 (1.00) DPP4F2HTR2ATAAR1ADRA2A
SCHEMBL150159 1.00 DPP4 (1.00) DPP4F2HTR2ATAAR1ADRA2A
SCHEMBL239938 1.00 DPP4 (1.00) DPP4F2HTR2ATAAR1ADRA2A
Ammonia Solution, Strong SCHEMBL4410348 0.97 DPP4 (0.93) DPP4F2HTR2ATAAR1ADRA2A
Hydrochloric Acid SCHEMBL9670481 0.97 DPP4 (0.93) DPP4F2HTR2ATAAR1ADRA2A
Lithium SCHEMBL31260781 0.97 DPP4 (0.93) DPP4F2HTR2ATAAR1ADRA2A
SCHEMBL10350027 0.97 DPP4 (0.93) DPP4F2HTR2ATAAR1ADRA2A
SCHEMBL6743969 0.97 DPP4 (0.93) DPP4F2HTR2ATAAR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025245089-A1 PROCESSES FOR PREPARING TETRALIN COMPOUNDS ARCUS BIOSCIENCES, INC. (US) 2025-11-27 WO claimed
US-12441700-B2 Hydrogenation of imines with RU complexes FIRMENICHI SA (CH) 2025-10-14 US claimed
CN-120040340-A Method and device for continuously catalyzing and synthesizing tetramethyl piperidone 潍坊元利新材料有限公司 2025-05-27 CN claimed
CN-115785155-B Novel diindole ligand compound and synthesis method and application thereof 凯特立斯(深圳)科技有限公司 2025-05-27 CN claimed
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
WO-2025074394-A1 A PROCESS FOR THE PREPARATION OF BELZUTIFAN AND ITS NOVEL INTERMEDIATES THEREOF NATCO PHARMA LIMITED (IN) 2025-04-10 WO claimed
CN-119775208-A Chiral bisimidazoline ligand containing cyclohexane skeleton structure and preparation method thereof 北京化工大学 2025-04-08 CN claimed
EP-3694864-B1 BORONIC ACID DERIVATIVES AND SYNTHESIS THEREOF QPEX BIOPHARMA INC (US) 2025-03-05 EP claimed
CN-114375290-B Novel synthetic options for preparing compounds 百时美施贵宝公司 2024-11-29 CN claimed
CN-118231127-A Schiff base nano zero-valent iron composite magnetic material and preparation method and application thereof 长安大学 2024-06-21 CN claimed
EP-1644384-B1 PROCESS AND INTERMEDIATES FOR THE SYNTHESIS OF ENTECAVIR BRISTOL MYERS SQUIBB CO (US) 2012-10-31 EP claimed
US-7550619-B2 Intermediates in the preparation of the antiviral agent [1S-(1α, 3α, 4β)]-2-amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxmethyl)-2-methylenecyclopentyl]-6H-purin-6-one BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-23 US claimed
US-20060106215-A1 Process for preparing the antiviral agent [1S-(1alpha, 3alpha, 4beta)]-2-amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]-6H-purin-6-one CHAN YEUNG Y 2006-05-18 US claimed
US-20060106216-A1 Process for preparing the antiviral agent [1S-(1alpha, 3alpha, 4beta)]-2-amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]-6H-purin-6-one PENDRI YADAGIRI R 2006-05-18 US claimed
US-20060020022-A1 Enantioselective separation method PHARMACIA & UPJOHN COMPANY LLC 2006-01-26 US claimed
US-20040192912-A1 Process for preparing the antiviral agent [1S-(1alpha,3 alpha,4beta)]-2-amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]-6H-purin-6-one BRISTOL-MYERS SQUIBB COMPANY 2004-09-30 US claimed
US-6747152-B2 COMPRISES MOLYBDENUM/TUNGSTEN/CHROMIUM COMPLEXES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2004-06-08 US claimed
US-20030191340-A1 Catalytic compositions and methods for asymmetric allylic alkylation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-10-09 US claimed
EP-1049537-B1 CATALYTIC COMPOSITIONS AND METHODS FOR ASYMMETRIC ALLYLIC ALKYLATION UNIV LELAND STANFORD JUNIOR (US) 2003-08-06 EP claimed
US-20020198383-A1 Catalytic compositions and methods for asymmetric allylic alkylation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-12-26 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 (7 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-12441700-B2 Hydrogenation of imines with RU complexes HRH3, HNMT, HRH4 DPP4 4188/4885F2 843/4885HTR2A 892/4885
US-20040192912-A1 Process for preparing the antiviral agent [1S-(1alpha,3 alpha,4beta)]-2-amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]-6H-purin-6-one SAMHD1, NUDT1, ENTPD1 DPP4 216/4885F2 3296/4885HTR2A 943/4885
US-20060106216-A1 Process for preparing the antiviral agent [1S-(1alpha, 3alpha, 4beta)]-2-amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]-6H-purin-6-one SAMHD1, NUDT1, ENTPD1 DPP4 261/4885F2 3383/4885HTR2A 999/4885
US-20020198383-A1 Catalytic compositions and methods for asymmetric allylic alkylation MPG, UNG, APOBEC3C DPP4 2820/4885F2 1620/4885HTR2A 4148/4885
US-20030191340-A1 Catalytic compositions and methods for asymmetric allylic alkylation MPG, UNG, APOBEC3C DPP4 2820/4885F2 1620/4885HTR2A 4148/4885
US-20060106215-A1 Process for preparing the antiviral agent [1S-(1alpha, 3alpha, 4beta)]-2-amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]-6H-purin-6-one SAMHD1, NUDT1, ENTPD1 DPP4 261/4885F2 3383/4885HTR2A 999/4885
US-20060020022-A1 Enantioselective separation method SLC7A1, SLC10A1, DHCR7 DPP4 814/4885F2 1561/4885HTR2A 1261/4885

“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.