SCHEMBL6556972

SCHEMBL6556972

Cc1ccc(COC(=O)Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.64
MMP2 P08253 2/20 0.49
MMP12 P39900 2/20 0.49
MMP1 P03956 1/20 0.49
MMP9 P14780 1/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
AGXT P21549 2/20 0.48
GAA P10253 1/20 0.48
MAOB P27338 1/20 0.47
P2RX4 Q99571 1/20 0.46
PARP10 Q53GL7 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
NAAA Q02083 1/20 0.45
HRH3 Q9Y5N1 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL8021350 0.89 ALDH1A1 (0.78) ALDH1A1MMP2MMP12MMP1MMP9
Toluene SCHEMBL5972420 0.86 ALDH1A1 (0.81) ALDH1A1RAB9ANPC1P2RX4MAPT
SCHEMBL11868697 0.83 ALDH1A1 (0.64) ALDH1A1RAB9ANPC1GAANAAA
SCHEMBL13892960 0.83 ALDH1A1 (0.64) ALDH1A1NPC1GAAMAPT
SCHEMBL26555 0.83 AGXT (0.52) ALDH1A1MMP2MMP12MMP1MMP9
SCHEMBL6646548 0.83 AGXT (0.52) ALDH1A1MMP2MMP12MMP1MMP9
Oxalic Acid SCHEMBL23420819 0.82 MMP2 (0.47) ALDH1A1MMP2MMP12MMP1MMP9
Oxalic Acid SCHEMBL23420818 0.82 MMP2 (0.47) ALDH1A1MMP2MMP12MMP1MMP9
P-Xylene SCHEMBL9685877 0.81 ALDH1A1 (0.67) ALDH1A1MMP2MMP12MMP1MMP9
SCHEMBL5369370 0.81 ALDH1A1 (0.50) ALDH1A1MMP2MMP12MMP1MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4119539-A1 PRODRUGS OF GAMMA-HYDROXYBUTYRIC ACID, COMPOSITIONS AND USES THEREOF XWPharma Ltd. (KY) 2023-01-18 EP disclosed
EP-4119539-A1 PRODRUGS OF GAMMA-HYDROXYBUTYRIC ACID, COMPOSITIONS AND USES THEREOF XWPharma Ltd. (KY) 2023-01-18 EP disclosed
EP-3353145-B1 PRODRUGS OF GAMMA-HYDROXYBUTYRIC ACID, COMPOSITIONS AND USES THEREOF XWPHARMA LTD (KY) 2022-09-28 EP disclosed
US-11001604-B2 Method for preparing tulathromycin WISDOM PHARMACEUTICAL CO., LTD. (CN) 2021-05-11 US disclosed
US-20210130281-A1 PRODRUGS OF GAMMA-HYDROXYBUTYRIC ACID, COMPOSITIONS AND USES THEREOF XWPharma Ltd. (KY) 2021-05-06 US disclosed
US-20210130281-A1 PRODRUGS OF GAMMA-HYDROXYBUTYRIC ACID, COMPOSITIONS AND USES THEREOF XWPharma Ltd. (KY) 2021-05-06 US disclosed
US-10941107-B2 Prodrugs of gamma-hydroxybutyric acid, compositions and uses thereof XW LABORATORIES INC. (KY) 2021-03-09 US disclosed
US-10941107-B2 Prodrugs of gamma-hydroxybutyric acid, compositions and uses thereof XW LABORATORIES INC. (KY) 2021-03-09 US disclosed
US-20210054007-A1 RECEPTOR INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) 2021-02-25 US disclosed
EP-3770148-A1 RECEPTOR INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF Beijing Tide Pharmaceutical Co., Ltd. (CN) 2021-01-27 EP disclosed
EP-0929217-B1 SORDARIN DERIVATIVES MERCK & CO INC (US) 2004-03-03 EP disclosed
EP-0542411-B1 TETRAHYDROTHIENOPYRIDINE DERIVATIVES, FURO AND PYRROLO ANALOGS THEREOF AND THEIR PREPARATION AND USES FOR INHIBITING BLOOD PLATELET AGGREGATION SANKYO CO (JP) 1998-08-12 EP disclosed
US-5571687-A TREATING CELLS WITH SPECIFIED COMPOUNDS TO EFFECT EXPRESSION OF MEMBRANE TRANSPORTER DUKE UNIVERSITY (US) 1996-11-05 US disclosed
WO-1995033847-A1 MODULATORS OF MULTIDRUG RESISTANCE TRANSPORTERS DUKE UNIVERSITY (US) 1995-12-14 WO disclosed
US-5436242-A Tetrahydrothienopyridine derivatives, furo and pyrrolo analogs thereof for inhibiting blood platelet aggregation SANKYO COMPANY, LIMITED (JP) 1995-07-25 US disclosed
US-5288726-A Tetrahydrothienopyridine derivatives, furo and pyrrolo analogs thereof and their preparation and uses for inhibiting blood platelet aggregation UBE INDUSTRIES LIMITED (JP) 1994-02-22 US disclosed
EP-0542411-A2 Tetrahydrothienopyridine derivatives, furo and pyrrolo analogs thereof and their preparation and uses for inhibiting blood platelet aggregation Sankyo Company Limited (JP) 1993-05-19 EP disclosed
US-4367230-A ANTIANOXIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1983-01-04 US disclosed
US-4228168-A ANTI-ANOXIC ACTIVITY TANABE SEIYAKU CO., LTD. (JP) 1980-10-14 US disclosed
US-4000297-A GASTROENTERIC ACTIVITY ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1976-12-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-10941107-B2 Prodrugs of gamma-hydroxybutyric acid, compositions and uses thereof GABRB2, GABRB3, GABRB1 ALDH1A1 869/4885MMP2 2909/4885MMP12 3124/4885
US-20210054007-A1 RECEPTOR INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF TACR1, TACR2, GPBAR1 ALDH1A1 1113/4885MMP2 2369/4885MMP12 2323/4885
US-11001604-B2 Method for preparing tulathromycin CYP51A1, DHFR, NISCH ALDH1A1 3122/4885MMP2 1515/4885MMP12 4069/4885
US-20210130281-A1 PRODRUGS OF GAMMA-HYDROXYBUTYRIC ACID, COMPOSITIONS AND USES THEREOF GABRB2, GABRB3, GABRB1 ALDH1A1 869/4885MMP2 2909/4885MMP12 3124/4885

“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.