SCHEMBL16657264

SCHEMBL16657264

COC(=O)/C=C/C(=O)OCC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 7/20 0.56
KEAP1 Q14145 1/20 0.56
NFE2L2 Q16236 1/20 0.56
ATM Q13315 1/20 0.39
GFPT1 Q06210 1/20 0.37
MAPT P10636 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
TYR P14679 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KMT2A Q03164 1/20 0.33
ALOX15 P16050 1/20 0.32

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
SCHEMBL5611325 0.91 HCAR2 (0.44) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL5611334 0.91 HCAR2 (0.44) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL8085681 0.91 HCAR2 (0.44) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL9239993 0.83 HCAR2 (0.59) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL6061013 0.83 HCAR2 (0.59) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL6061014 0.83 HCAR2 (0.59) HCAR2KEAP1NFE2L2ATMMAPT
SCHEMBL15499936 0.82 HCAR2 (0.50) HCAR2KEAP1NFE2L2ATMGFPT1
SCHEMBL15512022 0.82 HCAR2 (0.50) HCAR2KEAP1NFE2L2ATMGFPT1
SCHEMBL9242308 0.81 HCAR2 (0.54) HCAR2KEAP1NFE2L2ATMGFPT1
SCHEMBL4926884 0.81 HCAR2 (0.57) HCAR2KEAP1NFE2L2ATMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9988340-B2 Compositions and methods for the treatment of multiple sclerosis CELLIX BIO PRIVATE LIMITED (IN) 2018-06-05 US disclosed
US-9932294-B2 Compositions and methods for the treatment of multiple sclerosis CELLIX BIO PRIVATE LIMITED (IN) 2018-04-03 US disclosed
US-9580383-B2 Compositions and methods for the treatment of multiple sclerosis CELLIX BIO PRIVATE LIMITED (IN) 2017-02-28 US disclosed
US-9499526-B2 Compositions and methods for the treatment of neurologic diseases CELLIX BIO PRIVATE LIMITED (IN) 2016-11-22 US disclosed
US-9498461-B2 Compositions and methods for the treatment of inflammatory bowel disease CELLIX BIO PRIVATE LIMITED (IN) 2016-11-22 US disclosed
US-9434704-B2 Compositions and methods for the treatment of neurological degenerative disorders CELLIX BIO PRIVATE LIMITED (IN) 2016-09-06 US disclosed
US-9434729-B2 Compositions and methods for the treatment of periodontitis and rheumatoid arthritis CELLIX BIO PRIVATE LIMITED (IN) 2016-09-06 US disclosed
US-20160152553-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF MULTIPLE SCLEROSIS CELLIX BIO PRIVATE LIMITED (IN) 2016-06-02 US disclosed
US-9333187-B1 Compositions and methods for the treatment of inflammatory bowel disease CELLIX BIO PRIVATE LIMITED (IN) 2016-05-10 US disclosed
US-20160120839-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF INFLAMMATORY BOWEL DISEASE CELLIX BIO PRIVATE LIMITED (IN) 2016-05-05 US disclosed
US-9102649-B1 Compositions and methods for the treatment of multiple sclerosis CELLIX BIO PRIVATE LIMITED (IN) 2015-08-11 US disclosed
US-20150218136-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGIC DISEASES CELLIX BIO PRIVATE LIMITED (IN) 2015-08-06 US disclosed
US-20150152060-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT MIGRAINE AND NEUROLOGIC DISEASES CELLIX BIO PRIVATE LIMITED (IN) 2015-06-04 US disclosed
US-20150141384-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGICAL DEGENERATIVE DISORDERS KANDULA MAHESH (US) 2015-05-21 US disclosed
US-20150141513-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGICAL DEGENERATIVE DISORDERS AND NEUROLOGICAL DISEASES KANDULA MAHESH (IN) 2015-05-21 US disclosed
US-20150133407-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF RESPIRATORY DISORDERS CELLIX BIO PRIVATE LIMITED (IN) 2015-05-14 US disclosed
US-20150133475-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PERIODONTITIS AND RHEUMATOID ARTHRITIS CELLIX BIO PRIVATE LIMITED (IN) 2015-05-14 US disclosed
US-20150119424-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF EPILEPSY AND NEUROLOGICAL DISEASES KANDULA MAHESH (IN) 2015-04-30 US disclosed
US-20150119424-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF EPILEPSY AND NEUROLOGICAL DISEASES KANDULA MAHESH (IN) 2015-04-30 US disclosed
US-20150111932-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGICAL DEGENERATIVE DISORDERS CELLIX BIO PRIVATE LIMITED (IN) 2015-04-23 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 (10 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-20150133475-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PERIODONTITIS AND RHEUMATOID ARTHRITIS RORC, IL17A, PTGER1 HCAR2 359/4885KEAP1 4036/4885NFE2L2 3567/4885
US-20160152553-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF MULTIPLE SCLEROSIS HLA-DRB1, SI, PMP22 HCAR2 697/4885KEAP1 2114/4885NFE2L2 1945/4885
US-20150141513-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGICAL DEGENERATIVE DISORDERS AND NEUROLOGICAL DISEASES TARDBP, CHAT, COMT HCAR2 1180/4885KEAP1 608/4885NFE2L2 1147/4885
US-20150119424-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF EPILEPSY AND NEUROLOGICAL DISEASES SLC6A11, SCN1A, PSEN1 HCAR2 1421/4885KEAP1 1254/4885NFE2L2 2484/4885
US-20150218136-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGIC DISEASES PYGB, PSEN1, SI HCAR2 2404/4885KEAP1 1481/4885NFE2L2 2073/4885
US-20160120839-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF INFLAMMATORY BOWEL DISEASE ALPI, SLC10A2, SI HCAR2 354/4885KEAP1 1819/4885NFE2L2 1683/4885
US-20150111932-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGICAL DEGENERATIVE DISORDERS LPXN, HNRNPU, KYNU HCAR2 1984/4885KEAP1 1917/4885NFE2L2 1281/4885
US-20150133407-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF RESPIRATORY DISORDERS SORD, MUC1, CFTR HCAR2 933/4885KEAP1 705/4885NFE2L2 2404/4885
US-20150152060-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT MIGRAINE AND NEUROLOGIC DISEASES PSEN1, APP, PSEN2 HCAR2 1344/4885KEAP1 1618/4885NFE2L2 1882/4885
US-20150141384-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF NEUROLOGICAL DEGENERATIVE DISORDERS HTT, SNCA, PARK7 HCAR2 2199/4885KEAP1 362/4885NFE2L2 1580/4885

“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.