SCHEMBL1581948

SCHEMBL1581948

CCOC(=O)/C=C/C1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.47
L3MBTL1 Q9Y468 4/20 0.41
LMNA P02545 1/20 0.40
ALDH1A1 P00352 4/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
THRB P10828 1/20 0.39
ATM Q13315 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37

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
SCHEMBL9744701 1.00 HCAR2 (0.47) HCAR2L3MBTL1LMNAALDH1A1MAPT
SCHEMBL9744705 1.00 HCAR2 (0.47) HCAR2L3MBTL1LMNAALDH1A1MAPT
SCHEMBL14363086 1.00 HCAR2 (0.47) HCAR2L3MBTL1LMNAALDH1A1MAPT
SCHEMBL1581950 1.00 HCAR2 (0.47) HCAR2L3MBTL1LMNAALDH1A1MAPT
SCHEMBL425749 0.98 HCAR2 (0.48) HCAR2L3MBTL1LMNAALDH1A1MAPT
SCHEMBL425748 0.98 HCAR2 (0.48) HCAR2L3MBTL1LMNAALDH1A1MAPT
SCHEMBL1126533 0.94 HCAR2 (0.48) HCAR2L3MBTL1LMNAALDH1A1MAPT
SCHEMBL1126534 0.94 HCAR2 (0.48) HCAR2L3MBTL1LMNAALDH1A1MAPT
SCHEMBL587678 0.91 HCAR2 (0.43) HCAR2L3MBTL1LMNAALDH1A1MAPT
SCHEMBL7512241 0.90 HCAR2 (0.52) HCAR2L3MBTL1LMNAALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
EP-3538519-B1 INDAZOLE DERIVATIVES AS ALPHA V INTEGRIN ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2021-07-28 EP disclosed
US-11028071-B2 Indazole derivatives as alpha v integrin antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2021-06-08 US disclosed
US-20200339540-A1 INDAZOLE DERIVATIVES AS ALPHA V INTEGRIN ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2020-10-29 US disclosed
US-10745384-B2 Indazole derivatives as αv integrin antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2020-08-18 US disclosed
US-20190256496-A1 INDAZOLE DERIVATIVES AS ALPHA V INTEGRIN ANTAGONISTS BRISTOL MYERS SQUIBB CO (US) 2019-08-22 US disclosed
WO-2018089357-A1 INDAZOLE DERIVATIVES AS αV INTEGRIN ANTAGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-17 WO disclosed
US-8975269-B2 Six-membered N-heterocyclic carbene-based catalysts for asymmetric reactions FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION (US) 2015-03-10 US disclosed
US-20140336402-A1 LIGAND FORMING ASYMMETRICAL TRANSFORMATION CATALYST FOR MAKING NEW PHARMACEUTICALS NATIONAL SCIENCE FOUNDATION 2014-11-13 US disclosed
US-8822483-B2 Six-membered N-heterocyclic carbene-based catalysts for asymmetric reactions FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION (US) 2014-09-02 US disclosed
WO-2004063179-A1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS ELI LILLY AND COMPANY (US) 2004-07-29 WO disclosed
WO-2004009536-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS 4SC AG (DE) 2004-01-29 WO disclosed
US-5621133-A PREPARING A 1-(3,4-DIALKOXYPHENYL),3-HYDROXYALKANE(C6-C12) BY EPOXIDIZING A HALO DERIVATIVE WITH A BASE FOLLOWED BY DECYCLICIZING WITH AN ORGANOMETALLIC COMPOUND IN A SOLVENT; NAPHTHYLENES, ISOCHROMENES AND ISOTHIOCHROMENES DENINNO MICHAEL P (US) 1997-04-15 US disclosed
US-5591884-A PROTECTED HYDROXYALKYLCATECHOL INTERMEDIATES ABBOTT LABORATORIES (US) 1997-01-07 US disclosed
WO-1996038435-A1 DOPAMINE AGONISTS ABBOTT LABORATORIES (US) 1996-12-05 WO disclosed
EP-0474767-B1 DOPAMINE AGONISTS ABBOTT LAB (US) 1996-02-21 EP disclosed
EP-0474767-A4 DOPAMINE AGONISTS 1992-07-08 EP disclosed
EP-0474767-A1 DOPAMINE AGONISTS. ABBOTT LAB (US) 1992-03-18 EP disclosed
WO-1990015056-A1 DOPAMINE AGONISTS ABBOTT LABORATORIES (US) 1990-12-13 WO disclosed
US-4963568-A TREATMENT OF PARKINSON*S DISEASE, CARDIOVASCULAR DISORDERS ABBOTT LABORATORIES (US) 1990-10-16 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 (6 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-20200339540-A1 INDAZOLE DERIVATIVES AS ALPHA V INTEGRIN ANTAGONISTS ITGAV, ITGB1, ITGB3 HCAR2 2864/4885L3MBTL1 2890/4885LMNA 2016/4885
US-20190256496-A1 INDAZOLE DERIVATIVES AS ALPHA V INTEGRIN ANTAGONISTS ITGAV, ITGB1, ITGB3 HCAR2 2864/4885L3MBTL1 2890/4885LMNA 2016/4885
US-10745384-B2 Indazole derivatives as αv integrin antagonists ITGB3, ITGB1, ITGAV HCAR2 2587/4885L3MBTL1 2996/4885LMNA 2720/4885
US-20140336402-A1 LIGAND FORMING ASYMMETRICAL TRANSFORMATION CATALYST FOR MAKING NEW PHARMACEUTICALS CYP3A4, CYP3A5, CYP2C18 HCAR2 249/4885L3MBTL1 4662/4885LMNA 4687/4885
US-11028071-B2 Indazole derivatives as alpha v integrin antagonists ITGAV, ITGB1, ITGB3 HCAR2 2864/4885L3MBTL1 2890/4885LMNA 2016/4885
US-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 HCAR2 3926/4885L3MBTL1 3062/4885LMNA 264/4885

“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.