SCHEMBL121367

SCHEMBL121367

CCCOC(=O)N=NC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.42
LMNA P02545 2/20 0.39
ALDH1A1 P00352 4/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ESR1 P03372 1/20 0.34
CHRM1 P11229 1/20 0.34
TSHR P16473 1/20 0.34
SLC6A2 P23975 1/20 0.34
KDR P35968 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
PPP1CC P36873 1/20 0.33
ATM Q13315 1/20 0.31
MAPT P10636 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GLA P06280 1/20 0.31
NAAA Q02083 1/20 0.30
DGKA P23743 1/20 0.30

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
SCHEMBL14723127 1.00 HCAR2 (0.42) HCAR2LMNAALDH1A1GAASMN1; SMN2
SCHEMBL2677427 0.91 HCAR2 (0.43) HCAR2LMNAALDH1A1GAASMN1; SMN2
SCHEMBL1679083 0.91 HCAR2 (0.43) HCAR2LMNAALDH1A1GAASMN1; SMN2
SCHEMBL16114719 0.87 ALDH1A1 (0.50) HCAR2LMNAALDH1A1SMN1; SMN2ESR1
SCHEMBL1971178 0.87 ALDH1A1 (0.50) HCAR2LMNAALDH1A1SMN1; SMN2ESR1
SCHEMBL158106 0.87 ALDH1A1 (0.50) HCAR2LMNAALDH1A1SMN1; SMN2ESR1
SCHEMBL15865201 0.85 NAAA (0.48) HCAR2LMNAALDH1A1TSHRATM
SCHEMBL15842891 0.84 ALDH1A1 (0.42) HCAR2LMNAALDH1A1GAASMN1; SMN2
SCHEMBL15842890 0.84 ALDH1A1 (0.42) HCAR2LMNAALDH1A1GAASMN1; SMN2
SCHEMBL15864530 0.84 NAAA (0.52) HCAR2LMNAALDH1A1TSHRNAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3938374-A2 PHENYLPROPANOID SACCHARIDE ESTERS, METHODS AND USES THEREOF UNIVERSIDADE NOVA DE LISBOA (PT) 2022-01-19 EP claimed
WO-2020183442-A2 PHENYLPROPANOID SACCHARIDE ESTERS, METHODS AND USES THEREOF UNIVERSIDADE NOVA DE LISBOA (PT) 2020-09-17 WO claimed
WO-2014107447-A1 FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2014-07-10 WO claimed
EP-4540206-A2 MILD ELECTROCHEMICAL DECARBOXYLATIVE ALKYL-ALKYL COUPLING AND DECARBOXLATIVE OLEFINATION ENABLED BY RAPID ALTERNATING POLARITY The Scripps Research Institute (US) 2025-04-23 EP disclosed
WO-2024102639-A1 N-ARYLPYRAZOLE NOD2 AGONISTS AS PROMOTERS OF IMMUNE CHECKPOINT INHIBITOR THERAPY THE SCRIPPS RESEARCH INSTITUTE (US) 2024-05-16 WO disclosed
WO-2024091806-A1 INTERMOLECULAR BETA-METHYLENE C-H ARYLATION OF FREE ALIPHATIC ACIDS THE SCRIPPS RESEARCH INSTITUTE (US) 2024-05-02 WO disclosed
WO-2024091805-A2 HETEROARYLATION OF DIVERSE QUATERNARY CARBON CENTERS OF FREE CARBOXYLIC ACIDS THE SCRIPPS RESEARCH INSTITUTE (US) 2024-05-02 WO disclosed
WO-2024076951-A2 ANTIVIRAL PRODRUGS AND FORMULATIONS THEREOF THE SCRIPPS RESEARCH INSTITUTE (US) 2024-04-11 WO disclosed
WO-2024064731-A2 RAPID ENTRY INTO COTYLENIN CHEMICAL SPACE FOR DEVELOPMENT OF SELECTIVE 14-3-3 MOLECULAR GLUES THE SCRIPPS RESEARCH INSTITUTE (US) 2024-03-28 WO disclosed
WO-2024054881-A1 LIGAND-ENABLED SCALABLE C-H HYDROXYLATION OF BENZOIC AND PHENYLACETIC ACIDS AT ROOM TEMPERATURE THE SCRIPPS RESEARCH INSTITUTE (US) 2024-03-14 WO disclosed
WO-2024015889-A2 SMALL MOLECULE REGULATORS OF ALVEOLAR TYPE 2 CELL PROLIFERATION FOR THE TREATMENT OF PULMONARY DISEASES THE SCRIPPS RESEARCH INSTITUTE (US) 2024-01-18 WO disclosed
WO-2001046136-A1 HYDRAZONE AND OXIME DERIVATIVES OF PYRROLIDINE AS AMP-SPECIFIC PHOSPHODIESTERASE INHIBITORS ICOS CORPORATION (US) 2001-06-28 WO disclosed
WO-2001019831-A1 MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPases) NOVO NORDISK A/S (DK) 2001-03-22 WO disclosed
EP-0722430-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-07-24 EP disclosed
WO-1996004228-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-02-15 WO disclosed
WO-1994022883-A1 BACKBONE MODIFIED OLIGONUCLEOTIDES AND THEIR PREPARATION ISIS PHARMACEUTICALS, INC. (US) 1994-10-13 WO disclosed
WO-1994022454-A1 OLIGONUCLEOSIDE LINKAGES CONTAINING ADJACENT OXYGEN AND NITROGEN ATOMS ISIS PHARMACEUTICALS, INC. (US) 1994-10-13 WO disclosed
EP-0335355-A2 Bis-(hydroxymethyl) cyclobutyl purines and pyrimidines E.R. Squibb & Sons, Inc. (US) 1989-10-04 EP disclosed
EP-0194299-A1 PRODUCT BASED ON POLYVINYL CHLORIDE FOAM AND PROCESS OF PRODUCING SAME MASTER MARINE A.S. (NO) 1986-09-17 EP disclosed
WO-1986002036-A1 PRODUCT BASED ON POLYVINYL CHLORIDE FOAM AND PROCESS OF PRODUCING SAME MASTER MARINE A.S (NO) 1986-04-10 WO disclosed