SCHEMBL7582452

SCHEMBL7582452

CC(C)(C)C(=O)OC(O)CCO

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.46
THRB P10828 1/20 0.33
ELANE P08246 1/20 0.32
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31

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
SCHEMBL1142628 0.83 PRKCA (0.41) PRKCAELANE
SCHEMBL14700435 0.82 PRKCA (0.53) PRKCAELANE
SCHEMBL7474619 0.79 PRKCA (0.47) PRKCAELANE
SCHEMBL25380718 0.78 PRKCA (0.46) PRKCA
SCHEMBL25380720 0.78 PRKCA (0.46) PRKCA
Ammonia Solution, Strong SCHEMBL28509183 0.76 PRKCA (0.42) PRKCAELANE
SCHEMBL10977945 0.75
SCHEMBL3068283 0.74 THRB (0.41) THRB
SCHEMBL27906457 0.74 PRKCA (0.42) PRKCAELANE
SCHEMBL11595235 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180125986-A1 Nitric Oxide Releasing Produgs of Therapeutic Agents SATYAM APPARAO (IN) 2018-05-10 US claimed
US-9714560-B2 Protected scale inhibitors and methods relating thereto HALLIBURTON ENERGY SERVICES, INC. (US) 2017-07-25 US claimed
US-20150328323-A1 Nitric Oxide Releasing Produgs of Therapeutic Agents SATYAM APPARAO (IN) 2015-11-19 US claimed
WO-2014111957-A1 NITRIC OXIDE RELEASING PRODRUGS OF THERAPEUTIC AGENTS SATYAM APPARAO (IN) 2014-07-24 WO claimed
US-20220220134-A1 PHOSPHOHISTIDINE MIMETICS AND ANTIBODIES TO SAME THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2022-07-14 US disclosed
US-10351581-B2 Phosphohistidine mimetics and antibodies to same THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2019-07-16 US disclosed
US-20190092796-A1 PHOSPHOHISTIDINE MIMETICS AND ANTIBODIES TO SAME THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2019-03-28 US disclosed
US-20180125986-A1 Nitric Oxide Releasing Produgs of Therapeutic Agents SATYAM APPARAO (IN) 2018-05-10 US disclosed
US-9844599-B2 Nitric oxide releasing produgs of therapeutic agents SATYAM APPARAO (IN) 2017-12-19 US disclosed
US-9765154-B2 Phosphohistidine analogs THE ROCKEFELLER UNIVERSITY (US) 2017-09-19 US disclosed
US-9714560-B2 Protected scale inhibitors and methods relating thereto HALLIBURTON ENERGY SERVICES, INC. (US) 2017-07-25 US disclosed
US-20160311838-A1 PHOSPHOHISTIDINE MIMETICS AND ANTIBODIES TO SAME THE TRUSTEES OF PRINCETON UNIVERSITY 2016-10-27 US disclosed
US-20150328323-A1 Nitric Oxide Releasing Produgs of Therapeutic Agents SATYAM APPARAO (IN) 2015-11-19 US disclosed
US-9035068-B2 Phosphohistidine analogs THE ROCKEFELLER UNIVERSITY (US) 2015-05-19 US disclosed
WO-2015051079-A2 PHOSPHOHISTIDINE MIMETICS AND ANTIBODIES TO SAME THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2015-04-09 WO disclosed
WO-2014200757-A1 PROTECTED SCALE INHIBITORS AND METHODS RELATING THERETO HALLIBURTON ENERGY SERVICES, INC. (US) 2014-12-18 WO disclosed
US-20140367101-A1 Protected Scale Inhibitors and Methods Relating Thereto HALLIBURTON ENERGY SERVICES, INC. 2014-12-18 US disclosed
WO-2014111957-A1 NITRIC OXIDE RELEASING PRODRUGS OF THERAPEUTIC AGENTS SATYAM APPARAO (IN) 2014-07-24 WO disclosed
US-20130260398-A1 PHOSPHOHISTIDINE ANALOGS THE ROCKEFELLER UNIVERSITY (US) 2013-10-03 US disclosed
US-20020198125-A1 Water soluble package and liquid contents thereof UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-12-26 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 (7 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-20190092796-A1 PHOSPHOHISTIDINE MIMETICS AND ANTIBODIES TO SAME PHPT1, CD4, CD81 PRKCA 1859/4885THRB 3254/4885ELANE 4093/4885
US-20130260398-A1 PHOSPHOHISTIDINE ANALOGS PHPT1, PTMS, CHAMP1 PRKCA 1647/4885THRB 1136/4885ELANE 3685/4885
US-20180125986-A1 Nitric Oxide Releasing Produgs of Therapeutic Agents NOS2, NOS1, NOS3 PRKCA 1223/4885THRB 2315/4885ELANE 411/4885
US-20160311838-A1 PHOSPHOHISTIDINE MIMETICS AND ANTIBODIES TO SAME PHPT1, CD4, HCLS1 PRKCA 1129/4885THRB 3409/4885ELANE 4434/4885
US-20150328323-A1 Nitric Oxide Releasing Produgs of Therapeutic Agents NOS2, NOS1, PTGIS PRKCA 1285/4885THRB 2436/4885ELANE 416/4885
US-20220220134-A1 PHOSPHOHISTIDINE MIMETICS AND ANTIBODIES TO SAME PHPT1, CD4, CD81 PRKCA 1859/4885THRB 3254/4885ELANE 4093/4885
US-10351581-B2 Phosphohistidine mimetics and antibodies to same PHPT1, CD4, HCLS1 PRKCA 1129/4885THRB 3409/4885ELANE 4434/4885

“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.