Ritobegron

Ritobegron

SCHEMBL2947591

Cc1cc(OCC(=O)O)c(C)cc1CCN[C@@H](C)[C@H](O)c1ccc(O)cc1.Cl

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB3

The experimentally established mechanism targets of Ritobegron. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRB3 known ✓ P13945 7/20 0.63
LMNA P02545 2/20 0.51
SLC6A2 P23975 2/20 0.51
SLC6A4 P31645 2/20 0.51
OPRM1 P35372 2/20 0.51
HIF1A Q16665 2/20 0.51
TMEM97 Q5BJF2 1/20 0.51
SIGMAR1 Q99720 1/20 0.51
ADRB2 P07550 2/20 0.49
CYP2D6 P10635 1/20 0.49
GALR3 O60755 1/20 0.49
ADRB1 P08588 1/20 0.49
ADRA1A P35348 1/20 0.49
OPRK1 P41145 1/20 0.49
SLC6A3 Q01959 1/20 0.49

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
Ritobegron SCHEMBL2950593 1.00 ADRB3 (0.63) ADRB3LMNASLC6A2SLC6A4OPRM1
Ritobegron SCHEMBL2949688 1.00 ADRB3 (0.63) ADRB3LMNASLC6A2SLC6A4OPRM1
Ritobegron SCHEMBL2950589 1.00 ADRB3 (0.63) ADRB3LMNASLC6A2SLC6A4OPRM1
Ritobegron SCHEMBL1404071 0.99 ADRB3 (0.64) ADRB3LMNASLC6A2SLC6A4OPRM1
Ritobegron SCHEMBL4186380 0.99 ADRB3 (0.64) ADRB3LMNASLC6A2SLC6A4OPRM1
Ritobegron SCHEMBL5916906 0.99 ADRB3 (0.64) ADRB3LMNASLC6A2SLC6A4OPRM1
Ritobegron SCHEMBL1404072 0.99 ADRB3 (0.64) ADRB3LMNASLC6A2SLC6A4OPRM1
Ritobegron SCHEMBL4108225 0.93 ADRB3 (0.58) ADRB3LMNASLC6A2SLC6A4OPRM1
SCHEMBL13653968 0.91 ADRB3 (0.54) ADRB3LMNASLC6A2SLC6A4OPRM1
SCHEMBL13653975 0.91 ADRB3 (0.54) ADRB3LMNASLC6A2SLC6A4OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763654-B2 Crystal polymorph of hydroxynorephedrin derivative hydrochloride KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-07-27 US claimed
US-20100172988-A1 SUSTAINED RELEASE PREPARATION AND METHOD FOR PRODUCTION THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-07-08 US claimed
US-20090069421-A1 CRYSTAL POLYMORPH OF HYDROXYNOREPHEDRIN DERIVATIVE HYDROCHLORIDE KISSEI PHARMACEUTICAL CO., LTD, (JP) 2009-03-12 US claimed
US-7446128-B2 Agent for treating interstitial cystitis KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-11-04 US claimed
EP-1974725-A1 SUSTAINED RELEASE PREPARATION AND METHOD FOR PRODUCTION THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2008-10-01 EP claimed
EP-1620085-B1 USE OF PHENOXYACETIC ACID DERIVATIVES FOR TREATING HYPERACTIVE BLADDER KISSEI PHARMACEUTICAL (JP) 2008-07-23 EP claimed
EP-1878719-A1 CRYSTAL POLYMORPH OF HYDROXYNOREPHEDRIN DERIVATIVE HYDROCHLORIDE Kissei Pharmaceutical Co., Ltd. (JP) 2008-01-16 EP claimed
US-20070088174-A1 Synthesis of phenoxyacetic acid derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-04-19 US claimed
US-20050154041-A1 Pharmaceutical composition consisting of a beta-3-adrenoceptor agonist and alpha-agonist BOEHRINGER INGELHEIN INTERNATIONAL GMBH (DE) 2005-07-14 US claimed
US-7763654-B2 Crystal polymorph of hydroxynorephedrin derivative hydrochloride KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-07-27 US disclosed
US-7763654-B2 Crystal polymorph of hydroxynorephedrin derivative hydrochloride KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-07-27 US disclosed
US-20100172988-A1 SUSTAINED RELEASE PREPARATION AND METHOD FOR PRODUCTION THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-07-08 US disclosed
US-20100172988-A1 SUSTAINED RELEASE PREPARATION AND METHOD FOR PRODUCTION THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2010-07-08 US disclosed
US-20090247781-A1 SYNTHESIS OF PHENOXYACETIC ACID DERIVATIVES KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-10-01 US disclosed
US-20040242686-A1 Crystals of hydroxynorephedrine derivative KISSEI PHARMACEUTICAL CO. LTD. (JP) 2004-12-02 US disclosed
US-20040242686-A1 Crystals of hydroxynorephedrine derivative KISSEI PHARMACEUTICAL CO. LTD. (JP) 2004-12-02 US disclosed
WO-2004098586-A1 USE OF PHENOXYACETIC ACID DERIVATIVES FOR TREATING HYPERACTIVE BLADDER KISSEI PHARMACEUTICAL CO., LTD. (JP) 2004-11-18 WO disclosed
US-20040229947-A1 Method of treating hyperactive bladder using phenoxyacetic acid derivatives KISSEI PHARMACEUTICAL CO., LTD. 2004-11-18 US disclosed
EP-1426355-A1 CRYSTALS OF HYDROXYNOREPHEDRINE DERIVATIVE Kissei Pharmaceutical Co., Ltd. (JP) 2004-06-09 EP disclosed
EP-1426355-A1 CRYSTALS OF HYDROXYNOREPHEDRINE DERIVATIVE Kissei Pharmaceutical Co., Ltd. (JP) 2004-06-09 EP 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-20050154041-A1 Pharmaceutical composition consisting of a beta-3-adrenoceptor agonist and alpha-agonist ADRB3, ADRB2, ADRB1 ADRB3 1/4885LMNA 1686/4885SLC6A2 257/4885
US-20070088174-A1 Synthesis of phenoxyacetic acid derivatives DDC, PAH, HPD ADRB3 330/4885LMNA 2880/4885SLC6A2 49/4885
US-20040229947-A1 Method of treating hyperactive bladder using phenoxyacetic acid derivatives BPHL, HTR5A, PNMT ADRB3 123/4885LMNA 4385/4885SLC6A2 15/4885
US-20090069421-A1 CRYSTAL POLYMORPH OF HYDROXYNOREPHEDRIN DERIVATIVE HYDROCHLORIDE HTR3A, HTR3C, HTR3B ADRB3 536/4885LMNA 4007/4885SLC6A2 210/4885
US-20090247781-A1 SYNTHESIS OF PHENOXYACETIC ACID DERIVATIVES DDC, PAH, HPD ADRB3 315/4885LMNA 3124/4885SLC6A2 40/4885
US-20100172988-A1 SUSTAINED RELEASE PREPARATION AND METHOD FOR PRODUCTION THEREOF APEH, BPHL, UROD ADRB3 1337/4885LMNA 2967/4885SLC6A2 498/4885
US-20040242686-A1 Crystals of hydroxynorephedrine derivative ADRA2C, ADRB2, ADRA2A ADRB3 9/4885LMNA 2801/4885SLC6A2 151/4885

“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.