SCHEMBL197161

SCHEMBL197161

CC(C)(C)c1cc(-c2csc(CN)n2)cc(C(C)(C)C)c1O

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.71
CNR1 P21554 6/20 0.52
PTGS2 P35354 5/20 0.47
PTGS1 P23219 4/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42

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
Hydrochloric Acid SCHEMBL4576062 0.99 CNR2 (0.69) CNR2CNR1PTGS2PTGS1CA1
SCHEMBL5097779 0.89 CNR2 (0.67) CNR2CNR1PTGS2PTGS1CA1
SCHEMBL1929381 0.87 CNR2 (0.72) CNR2CNR1PTGS2PTGS1CA1
SCHEMBL1928747 0.85 CNR2 (0.71) CNR2CNR1PTGS2PTGS1CA1
SCHEMBL4037941 0.83 CNR2 (0.50) CNR2CNR1PTGS2PTGS1
SCHEMBL1926401 0.83 CNR2 (0.67) CNR2CNR1PTGS2PTGS1CA1
SCHEMBL1927474 0.83 CNR2 (0.67) CNR2CNR1PTGS2PTGS1CA1
SCHEMBL2348536 0.83 CNR2 (1.00) CNR2CNR1PTGS2PTGS1CA1
Hydrochloric Acid SCHEMBL1927169 0.82 CNR2 (0.97) CNR2CNR1PTGS2PTGS1CA1
Hydrochloric Acid SCHEMBL1928142 0.82 CNR2 (0.66) CNR2CNR1PTGS2PTGS1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1904063-B1 THIAZOLE DERIVATIVES FOR THE TREATMENT OF DYSKINESIAS CAUSED BY A CHEMICAL TREATMENT IPSEN PHARMA (FR) 2019-02-20 EP claimed
US-9918967-B2 Thiazole derivatives for treating dyskinesias caused by a chemical treatment IPSEN PHARMA S.A.S. (FR) 2018-03-20 US claimed
US-20150238468-A1 THIAZOLE DERIVATIVES FOR TREATING DYSKINESIAS CAUSED BY A CHEMICAL TREATMENT IPSEN PHARMA S.A.S. (FR) 2015-08-27 US claimed
US-8288560-B2 Derivatives of heterocycles with 5 members, their preparation and their use as medicaments IPSEN PHARMA S.A.S. (FR) 2012-10-16 US claimed
JP-2012500283-A 2012-01-05 JP claimed
US-20110190356-A1 Compositions and Methods of Using (R)- Pramipexole KNOPP NEUROSCIENCES INC. (US) 2011-08-04 US claimed
US-20110172434-A1 DERIVATIVES OF HETEROCYCLES WITH 5 MEMBERS, THEIR PREPARATION AND THEIR USE AS MEDICAMENTS IPSEN PHARMA S.A.S. (FR) 2011-07-14 US claimed
EP-2334185-A1 COMPOSITIONS AND METHODS OF USING (R)-PRAMIPEXOLE Knopp Neurosciences, Inc. (US) 2011-06-22 EP claimed
US-7956075-B2 Thiazole, oxazole, imidazole, isoxazole and isoxazoline derivatives, e.g., butyl 2-(4-[1,1'-biphenyl]-4-yl-1H-imidazol-2-yl)ethylcarbamate inhibit lipidic peroxidation and monoamine oxidase and modulate sodium channels and are used for treating neurodegenerative disorders or pain. IPSEN PHARMA S.A.S. (FR) 2011-06-07 US claimed
WO-2010022140-A1 COMPOSITIONS AND METHODS OF USING (R)-PRAMIPEXOLE KNOPP NEUROSCIENCES, INC. (US) 2010-02-25 WO claimed
WO-2007006941-A1 THIAZOLE DERIVATIVES FOR THE TREATMENT OF RESTLESS LEGS SYNDROME SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2007-01-18 WO claimed
WO-2007006942-A1 THIAZOLE DERIVATIVES FOR THE TREATMENT OF DYSKINESIAS CAUSED BY A CHEMICAL TREATMENT SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUE (S.C.R.A.S.) (FR) 2007-01-18 WO claimed
EP-1223933-B1 5-MEMBERED HETEROCYCLE DERIVATIVES AND USE THEREOF AS MONOAMINOXIDASE INHIBITORS SOD CONSEILS RECH APPLIC (FR) 2006-09-06 EP claimed
EP-1414447-B1 USE OF THIAZOLE DERIVATIVES FOR PREPARING A MEDICINE FOR PROTECTING MITOCHONDRIA SOD CONSEILS RECH APPLIC (FR) 2006-07-26 EP claimed
US-20050038087-A1 Derivatives of heterocycles with 5 members, their preparation and their use as medicaments IPSEN PHARMA S.A.S. (FR) 2005-02-17 US claimed
US-20040132788-A1 Derivatives of heterocycles with 5 members, their preparation and their use as medicaments SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2004-07-08 US claimed
EP-1414447-A1 USE OF THIAZOLE DERIVATIVES FOR PREPARING A MEDICINE FOR PROTECTING MITOCHONDRIA SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2004-05-06 EP claimed
WO-2003009843-A1 USE OF THIAZOLE DERIVATIVES FOR PREPARING A MEDICINE FOR PROTECTING MITOCHONDRIA SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2003-02-06 WO claimed
EP-1223933-A2 5-MEMBERED HETEROCYCLE DERIVATIVES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2002-07-24 EP claimed
WO-2001026656-A2 5-MEMBERED HETEROCYCLE DERIVATIVES AND USE THEREOF AS MONOAMINE OXIDASE INHIBITORS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2001-04-19 WO claimed

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

For each of this compound's patents that has machine-readable text (5 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-20050038087-A1 Derivatives of heterocycles with 5 members, their preparation and their use as medicaments OXER1, OPRL1, OPRK1 CNR2 22/4885CNR1 13/4885PTGS2 364/4885
US-20040132788-A1 Derivatives of heterocycles with 5 members, their preparation and their use as medicaments OPRK1, HCN1, P2RX7 CNR2 15/4885CNR1 5/4885PTGS2 366/4885
US-20110172434-A1 DERIVATIVES OF HETEROCYCLES WITH 5 MEMBERS, THEIR PREPARATION AND THEIR USE AS MEDICAMENTS OXER1, OPRL1, CHRNA7 CNR2 27/4885CNR1 17/4885PTGS2 427/4885
US-20150238468-A1 THIAZOLE DERIVATIVES FOR TREATING DYSKINESIAS CAUSED BY A CHEMICAL TREATMENT COMT, SLC6A3, PARK7 CNR2 846/4885CNR1 1172/4885PTGS2 1019/4885
US-20110190356-A1 Compositions and Methods of Using (R)- Pramipexole HSPE1, GRIN2B, GRIN2A CNR2 3952/4885CNR1 4093/4885PTGS2 1003/4885

“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.