SCHEMBL5269737

SCHEMBL5269737

Cc1ccc2c(c1)[C@@H](c1ccccc1)CC(=O)O2

nearest known ligand 0.79

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.79
ALDH2 P05091 1/20 0.79
HPGD P15428 4/20 0.70
GAA P10253 2/20 0.70
HSD17B10 Q99714 1/20 0.70
GLA P06280 1/20 0.67
SIRT2 Q8IXJ6 5/20 0.64
MEN1 O00255 4/20 0.59
MAPT P10636 4/20 0.59
KMT2A Q03164 4/20 0.59
RECQL P46063 1/20 0.59
THRB P10828 2/20 0.58

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
SCHEMBL5269218 1.00 ALDH1A1 (0.79) ALDH1A1ALDH2HPGDGAAHSD17B10
SCHEMBL820663 1.00 ALDH1A1 (0.79) ALDH1A1ALDH2HPGDGAAHSD17B10
SCHEMBL4878921 0.88 ALDH1A1 (1.00) ALDH1A1ALDH2HPGDGAAHSD17B10
SCHEMBL725197 0.82 ALDH1A1 (0.70) ALDH1A1ALDH2HPGDGAAHSD17B10
SCHEMBL9228116 0.82 ALDH1A1 (0.70) ALDH1A1ALDH2HPGDGAAHSD17B10
SCHEMBL12856664 0.82 ALDH1A1 (0.70) ALDH1A1ALDH2HPGDGAAHSD17B10
SCHEMBL580157 0.82 ALDH1A1 (0.73) ALDH1A1ALDH2HPGDGAAHSD17B10
SCHEMBL579722 0.82 ALDH1A1 (0.65) ALDH1A1ALDH2HPGDGAAHSD17B10
SCHEMBL9223130 0.81 ALDH1A1 (0.68) ALDH1A1ALDH2HPGDGAAHSD17B10
SCHEMBL14852665 0.81 ALDH1A1 (0.68) ALDH1A1ALDH2HPGDGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1584621-B1 A process for the preparation of tolterodine and intermediates thereof DIPHARMA FRANCIS SRL (IT) 2007-06-13 EP claimed
US-7119212-B2 Process for the preparation of tolterodine and intermediates thereof DIPHARMA S.P.A. (IT) 2006-10-10 US claimed
EP-1584621-A1 A process for the preparation of tolterodine and intermediates thereof Dipharma S.p.A. (IT) 2005-10-12 EP claimed
US-20050222437-A1 Process for the preparation of tolterodine and intermediates thereof DIPHARMA S.P.A. (IT) 2005-10-06 US claimed
US-9309215-B2 Chiral intermediate, process for producing the same and its use in the manufacture of tolterodine, fesoterodine, or the active metabolite thereof UCB PHARMA GMBH (DE) 2016-04-12 US disclosed
US-20140228434-A1 CHIRAL INTERMEDIATE, PROCESS FOR PRODUCING THE SAME AND ITS USE IN THE MANUFACTURE OF TOLTERODINE, FESOTERODINE, OR THE ACTIVE METABOLITE THEREOF UCB PHARMA GMBH (DE) 2014-08-14 US disclosed
US-8742140-B2 Chiral intermediate, process for producing the same and its use in the manufacture of tolterodine, fesoterodine, or the active metabolite thereof UCB PHARMA GMBH (DE) 2014-06-03 US disclosed
US-20110281952-A1 DEUTERIUM-ENRICHED TOLTERODINE PROTIA, LLC (US) 2011-11-17 US disclosed
US-20110245338-A1 CHIRAL INTERMEDIATE, PROCESS FOR PRODUCING THE SAME AND ITS USE IN THE MANUFACTURE OF TOLTERODINE, FESOTERODINE, OR THE ACTIVE METABOLITE THEREOF UCB PHARMA GMBH (DE) 2011-10-06 US disclosed
US-7982058-B2 Chiral intermediate, process for producing the same and its use in the manufacture of tolterodine, fesoterodine, or the active metabolite thereof UCB PHARMA GMBH (DE) 2011-07-19 US disclosed
US-20090192224-A1 CHIRAL INTERMEDIATE, PROCESS FOR PRODUCING THE SAME AND ITS USE IN THE MANUFACTURE OF TOLTERODINE, FESOTERODINE, OR THE ACTIVE METABOLITE THEREOF SCHWARZ PHARMA AG (DE) 2009-07-30 US disclosed
US-20090062398-A1 DEUTERIUM-ENRICHED TOLTERODINE PROTIA, LLC (US) 2009-03-05 US disclosed
US-20070010691-A1 Enantioselective synthesis of enantiomerically enriched compounds CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 2007-01-11 US disclosed
US-7119212-B2 Process for the preparation of tolterodine and intermediates thereof DIPHARMA S.P.A. (IT) 2006-10-10 US disclosed
US-7119212-B2 Process for the preparation of tolterodine and intermediates thereof DIPHARMA S.P.A. (IT) 2006-10-10 US disclosed
JP-2005281311-A METHOD FOR PRODUCING TOLTERODINE AND ITS INTERMEDIATE DIPHARMA SPA 2005-10-13 JP disclosed
EP-1584621-A1 A process for the preparation of tolterodine and intermediates thereof Dipharma S.p.A. (IT) 2005-10-12 EP disclosed
EP-1584621-A1 A process for the preparation of tolterodine and intermediates thereof Dipharma S.p.A. (IT) 2005-10-12 EP disclosed
US-20050222437-A1 Process for the preparation of tolterodine and intermediates thereof DIPHARMA S.P.A. (IT) 2005-10-06 US disclosed
US-20050222437-A1 Process for the preparation of tolterodine and intermediates thereof DIPHARMA S.P.A. (IT) 2005-10-06 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-20050222437-A1 Process for the preparation of tolterodine and intermediates thereof CYP2B6, UGT1A6, CYP2D6 ALDH1A1 1277/4885ALDH2 1890/4885HPGD 1820/4885
US-20090062398-A1 DEUTERIUM-ENRICHED TOLTERODINE SLC6A3, AVPR2, TBCD ALDH1A1 3032/4885ALDH2 3195/4885HPGD 517/4885
US-20090192224-A1 CHIRAL INTERMEDIATE, PROCESS FOR PRODUCING THE SAME AND ITS USE IN THE MANUFACTURE OF TOLTERODINE, FESOTERODINE, OR THE ACTIVE METABOLITE THEREOF CYP1B1, NISCH, HSD17B7 ALDH1A1 780/4885ALDH2 1270/4885HPGD 498/4885
US-20110245338-A1 CHIRAL INTERMEDIATE, PROCESS FOR PRODUCING THE SAME AND ITS USE IN THE MANUFACTURE OF TOLTERODINE, FESOTERODINE, OR THE ACTIVE METABOLITE THEREOF CYP1B1, NISCH, HSD17B7 ALDH1A1 780/4885ALDH2 1270/4885HPGD 498/4885
US-20070010691-A1 Enantioselective synthesis of enantiomerically enriched compounds CYP8B1, SRD5A2, CYP11B2 ALDH1A1 876/4885ALDH2 1169/4885HPGD 692/4885
US-20110281952-A1 DEUTERIUM-ENRICHED TOLTERODINE SLC6A3, AVPR2, TBCD ALDH1A1 3032/4885ALDH2 3195/4885HPGD 517/4885
US-20140228434-A1 CHIRAL INTERMEDIATE, PROCESS FOR PRODUCING THE SAME AND ITS USE IN THE MANUFACTURE OF TOLTERODINE, FESOTERODINE, OR THE ACTIVE METABOLITE THEREOF CYP1B1, NISCH, HSD17B7 ALDH1A1 780/4885ALDH2 1270/4885HPGD 498/4885

“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.