SCHEMBL3075458

SCHEMBL3075458

CCC(C)(C)OC(=O)CN

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HTR2C P28335 1/20 0.32
TLR8 Q9NR97 1/20 0.32
TLR7 Q9NYK1 1/20 0.32
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 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
SCHEMBL18274730 0.83 KDM4E (0.34) KDM4ELMNA
SCHEMBL12559796 0.83 GAA (0.34) TDP1KDM4ELMNA
SCHEMBL4593017 0.82 LMNA (0.39) ALDH1A1TSHRTDP1HTR2CTLR8
SCHEMBL19822063 0.82 CYP1A2 (0.38) ALDH1A1TSHRTDP1CYP1A2
SCHEMBL28098710 0.81 KDM4E (0.31) TDP1KDM4ELMNA
SCHEMBL28806657 0.81 CYP1A2 (0.33) HTR2CKDM4ELMNACYP1A2
Hydrochloric Acid SCHEMBL3067297 0.80 CYP1A2 (0.36) ALDH1A1TSHRTDP1KDM4ELMNA
SCHEMBL12559721 0.80 NAAA (0.32) ALDH1A1HTR2CTLR8TLR7LMNA
SCHEMBL2380925 0.80 ALDH1A1 (0.39) ALDH1A1TSHRTDP1CYP1A2
SCHEMBL142215 0.80 TSHR (0.39) ALDH1A1TSHRTDP1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0141269-B1 MODIFIED POLYVINYL ALCOHOL POLYMERS ICI AMERICAS INC. (US) 1989-08-23 EP claimed
US-20230357347-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS CARMOT THERAPEUTICS, INC. 2023-11-09 US disclosed
WO-2023178299-A1 PRODRUGS OF GANAXOLONE MARINUS PHARMACEUTICALS, INC. (US) 2023-09-21 WO disclosed
CN-106061942-B Novel CYP-eicosanoid derivatives 分子医学马克斯德尔布吕克中心 2019-11-15 CN disclosed
CN-110072883-A The relevant peptide of therapeutic MOTS-C 科巴公司 2019-07-30 CN disclosed
EP-3492526-A1 RESIN COMPOSITION AND USE THEREOF Sumitomo Chemical Company Limited (JP) 2019-06-05 EP disclosed
CN-109574865-A Monoamine oxidase-B selective depression immunomodulator compounds, its pharmaceutical composition and application 英属哥伦比亚大学 2019-04-05 CN disclosed
CN-109562083-A CYP-eicosanoid analogs for treatment or prevention of diseases associated with neovascularization and/or inflammation 奥迈科斯治疗公司 2019-04-02 CN disclosed
CN-109414475-A New type of peptides and peptide mimics 奥克兰大学 2019-03-01 CN disclosed
CN-105793234-B Monoamine oxidase-B selective inhibitor compound, pharmaceutical composition and application thereof 英属哥伦比亚大学 2018-10-12 CN disclosed
CN-108349880-A The steady analog of CYP eicosanoid metabolics for treating heart disease 奥迈科斯治疗公司 2018-07-31 CN disclosed
CN-105007990-B The purposes of cosmetic composition from fish artemia hatching solution, its production method and its aesthetic appearance for being used to improving skin 阿克生物科技公司 2018-04-06 CN disclosed
CN-106999534-A Composition and method for treating acute radiation syndrome 倍奥英赛普特有限责任公司 2017-08-01 CN disclosed
CN-105793234-A Monoamine oxidase-B selective inhibitor compound, pharmaceutical composition and application thereof 英属哥伦比亚大学 2016-07-20 CN disclosed
US-8778919-B2 Cyclic anilino—pyridinotriazines JANSSEN PHARMACEUTICA NV (BE) 2014-07-15 US disclosed
US-20100222574-A1 CYCLIC ANILINO - PYRIDINOTRIAZINES JANSSEN PHARMACEUTICA N.V. (BE) 2010-09-02 US disclosed
EP-1904461-B1 CYCLIC ANILINO-PYRIDINOTRIAZINES AS GSK-3 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-08-12 EP disclosed
CN-1330712-A Biogical compositions, components thereof and uses therefor MELBOURNE HEALCH CARE LTD (AU) 2002-01-09 CN 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 (2 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-20230357347-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS GIPR, GLP1R, GCGR ALDH1A1 3305/4885TSHR 140/4885TDP1 3206/4885
US-20100222574-A1 CYCLIC ANILINO - PYRIDINOTRIAZINES NR4A1, NR4A2, NR5A2 ALDH1A1 2052/4885TSHR 767/4885TDP1 3803/4885

“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.