SCHEMBL73176

SCHEMBL73176

O=[C]CC1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.52
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
FABP7 O15540 1/20 0.38
FABP5 Q01469 1/20 0.38
GPR3 P46089 2/20 0.37
TSHR P16473 2/20 0.37
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
NCOR2 Q9Y618 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
CYP1A2 P05177 1/20 0.35
TDO2 P48775 1/20 0.35

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
SCHEMBL28116360 0.84 HTR2A (0.39) HTR2ACA1CA2FABP7FABP5
SCHEMBL2121843 0.78 HTR2A (0.48) HTR2ACA1CA2FABP7FABP5
SCHEMBL8664361 0.77 HTR2A (0.52) HTR2ACA1CA2GPR3TSHR
SCHEMBL2435025 0.77 HTR2A (0.52) HTR2ACA1CA2GPR3TSHR
SCHEMBL2069075 0.77 HTR2A (0.52) HTR2ACA1CA2FABP7FABP5
SCHEMBL218397 0.73 HTR2A (0.58) HTR2ACA1CA2FABP7FABP5
SCHEMBL1509215 0.72 HTR2A (0.47) HTR2ACA1CA2TSHRHDAC3
SCHEMBL7764 0.72 CA1 (0.53) HTR2ACA1CA2FABP7FABP5
SCHEMBL5353138 0.72 HTR2A (0.64) HTR2ACA1CA2GPR3KMT2A
SCHEMBL7576966 0.72 HTR2A (0.64) HTR2ACA1CA2GPR3TSHR

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

Appears in 2269 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118084734-A Preparation method of O- [2- [ [ tert-butoxycarbonyl ] amino ] ethyl ] -N- [ fluorenylmethoxycarbonyl ] -L-tyrosine 成都海杰亚医药科技有限公司 2024-05-28 CN claimed
US-20240158441-A1 BRANCHED PEPTIDES FOR ENZYMATIC ASSEMBLY AND MITOCHONDRIA DRUG DELIVERY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-05-16 US claimed
WO-2024089191-A1 MICROBIOCIDAL HETEROBICYCLIC DIHYDROOXADIAZINE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2024-05-02 WO claimed
US-20240051992-A1 THIOPHOSPHOPEPTIDES FOR ULTRAFAST TARGETING OF THE GOLGI APPARATUS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-02-15 US claimed
US-11834517-B2 Branched peptides for enzymatic assembly and mitochondria drug delivery BRANDEIS UNIVERSITY (US) 2023-12-05 US claimed
US-11779653-B2 Multi-armed polyrotaxane platform for protected nucleic acid delivery THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-10-10 US claimed
WO-2023183908-A1 TYK2 INHIBITOR SYNTHESIS AND INTERMEDIATES THEREOF NIMBUS LAKSHMI, INC. (US) 2023-09-28 WO claimed
EP-3565573-B1 PAC1 RECEPTOR AGONISTS (MAXCAPS) AND USES THEREOF UNIV CALIFORNIA (US) 2023-08-23 EP claimed
US-11673957-B2 Anti-ROR2 antibodies Eureka Therapeutics, Inc. (US) 2023-06-13 US claimed
WO-2023090935-A1 METHOD FOR PRODUCING AGM PEPTIDES THAT BIND SPECIFICALLY TO NUCLEOLIN 애니젠 주식회사 2023-05-25 WO claimed
EP-0255082-B1 Renin-inhibiting di- and tripeptides, methods for their production, drugs containing them, and their use HOECHST AG (DE) 1993-12-01 EP claimed
US-5250517-A Hypotensive and cardiotonic agents; cardiac insufficiency HOFFMANN-LA ROCHE INC. (US) 1993-10-05 US claimed
EP-0538399-A1 CYCLIC CELL ADHESION MODULATION COMPOUNDS TANABE SEIYAKU CO., LTD. (JP) 1993-04-28 EP claimed
EP-0517589-A2 Tachykinin derivatives, their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-12-09 EP claimed
WO-1992000995-A1 CYCLIC CELL ADHESION MODULATION COMPOUNDS TANABE SEIYAKU CO. LTD. (JP) 1992-01-23 WO claimed
EP-0394829-A1 Renin-inhibiting dipeptides, process to synthetize them, compositions containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1990-10-31 EP claimed
US-4855286-A HYPOTENSIVE AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1989-08-08 US claimed
EP-0255082-A2 Renin-inhibiting di- and tripeptides, methods for their production, drugs containing them, and their use HOECHST AKTIENGESELLSCHAFT (DE) 1988-02-03 EP claimed
EP-0239874-A2 Substituted derivatives of 4-amino-3-hydroxy-butyric acid, process for their production, medicines containing them, and their application HOECHST AKTIENGESELLSCHAFT (DE) 1987-10-07 EP claimed
EP-0230242-A2 Substituted derivatives of 4-amino-3-hydroxy-butyric acid, process for their production, medicines containing them, and their use HOECHST AKTIENGESELLSCHAFT (DE) 1987-07-29 EP claimed