SCHEMBL2789512

SCHEMBL2789512

COC(=O)CC(c1ccccc1)c1cc(C)ccc1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.54
▸ GAA P10253 3/20 0.54
▸ ALDH1A1 P00352 5/20 0.50
▸ MAPT P10636 3/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ RECQL P46063 1/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ LMNA P02545 1/20 0.46
▸ HTT P42858 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ BRD4 O60885 1/20 0.45
▸ TNF P01375 1/20 0.44
▸ PDE4A P27815 1/20 0.44
▸ PDE4B Q07343 1/20 0.44
▸ PDE4C Q08493 1/20 0.44
▸ PDE4D Q08499 1/20 0.44
▸ MDM2 Q00987 1/20 0.44
▸ LPAR1 Q92633 2/20 0.44

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
SCHEMBL9228309 0.90 L3MBTL1 (0.47) KMT2AGAAALDH1A1MAPTL3MBTL1
SCHEMBL30232579 0.89 KMT2A (0.54) KMT2AGAAALDH1A1MAPTL3MBTL1
SCHEMBL617039 0.89 KMT2A (0.54) KMT2AGAAALDH1A1MAPTL3MBTL1
SCHEMBL9224006 0.86 KMT2A (0.52) KMT2AGAAALDH1A1MAPTL3MBTL1
SCHEMBL4832151 0.86 GAA (0.48) KMT2AGAAALDH1A1MAPTNPSR1
SCHEMBL9228927 0.85 LMNA (0.55) KMT2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL13196103 0.85 L3MBTL1 (0.47) KMT2AGAAALDH1A1MAPTL3MBTL1
SCHEMBL1582638 0.85 HPGD (0.62) KMT2AGAAALDH1A1MAPTMEN1
SCHEMBL19212486 0.84 GAA (0.44) KMT2AGAAALDH1A1MAPTL3MBTL1
SCHEMBL580391 0.84 NPSR1 (0.48) KMT2AGAAALDH1A1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1419135-A4 PROCESS FOR THE PREPARATION OF TOLTERODINE RANBAXY LAB LTD (IN) 2006-01-11 — — EP claimed
US-20040249211-A1 PROCESS FOR THE PREPARATION OF TOLTERODINE RANBAXY LABORATORIES LIMITED (IN) 2004-12-09 — — US claimed
US-6822119-B1 REACTING 3,4-DIHYDRO-6-METHYL-4-PHENYL-2H-BENZOPYRAN-2-ONE WITH DIMETHYL SULFATE USING PHASE TRANSFER CATALYST; DESTERIFICATION, REDUCTION, AMINATION, SULFONATION, DEPROTECTING, DECYCLIZATION, AND SALT FORMATION RANBAXY LABORATORIES LIMITED (IN) 2004-11-23 — — US claimed
EP-1419135-A1 PROCESS FOR THE PREPARATION OF TOLTERODINE RANBAXY LABORATORIES, LTD. (IN) 2004-05-19 — — EP claimed
WO-2003014060-A1 PROCESS FOR THE PREPARATION OF TOLTERODINE RANBAXY LABORATORIES LIMITED (IN) 2003-02-20 — — WO claimed
US-9085509-B2 Process for preparing fesoterodine ALEMBIC PHARMACEUTICALS LIMITED (IN) 2015-07-21 — — US disclosed
US-9085509-B2 Process for preparing fesoterodine ALEMBIC PHARMACEUTICALS LIMITED (IN) 2015-07-21 — — US disclosed
US-20140039216-A1 PROCESS FOR PREPARING FESOTERODINE ALEMBIC PHARMACEUTICALS LIMITED (IN) 2014-02-06 — — US disclosed
US-20140039216-A1 PROCESS FOR PREPARING FESOTERODINE ALEMBIC PHARMACEUTICALS LIMITED (IN) 2014-02-06 — — US disclosed
EP-1701932-B1 TOLTERODINE, COMPOSITIONS AND USES THEREOF, AND PREPARATION OF THE SAME CIPLA LTD (IN) 2012-07-18 — — EP disclosed
EP-1701932-B1 TOLTERODINE, COMPOSITIONS AND USES THEREOF, AND PREPARATION OF THE SAME CIPLA LTD (IN) 2012-07-18 — — EP disclosed
US-20120041235-A1 PROCESS FOR THE PREPARATION OF (R)-2-(3-DIISOPROPYLAMINO)-1-PHENYLPROPYL)-4METHYLPHENOL AND SALTS THEREOF PHARMATHEN S.A. (GR) 2012-02-16 — — US disclosed
WO-2007039918-A1 NOVEL PROCESS FOR THE PREPARATION OF TOLTERODINE NATCO PHARMA LIMITED (IN) 2007-04-12 — — WO disclosed
US-20060094904-A1 Reacting methyl 3-(2-benzyloxy-5-methyl phenyl)-3-phenylpropionate with a reducing agent to form 3-(2-benzyloxy-5-methylphenyl)-3-phenylpropanol DR. REDDY'S LABORATORIES LIMITED (IN) 2006-05-04 — — US disclosed
US-20060079716-A1 Process for the preparation of N,N-diisopropyl-3-(2-hydroxy-5-methylphenyl)-3-phenyl-propaneamine CHEMI SPA (IT) 2006-04-13 — — US disclosed
EP-1419135-A4 PROCESS FOR THE PREPARATION OF TOLTERODINE RANBAXY LAB LTD (IN) 2006-01-11 — — EP disclosed
US-20040249211-A1 PROCESS FOR THE PREPARATION OF TOLTERODINE RANBAXY LABORATORIES LIMITED (IN) 2004-12-09 — — US disclosed
US-6822119-B1 REACTING 3,4-DIHYDRO-6-METHYL-4-PHENYL-2H-BENZOPYRAN-2-ONE WITH DIMETHYL SULFATE USING PHASE TRANSFER CATALYST; DESTERIFICATION, REDUCTION, AMINATION, SULFONATION, DEPROTECTING, DECYCLIZATION, AND SALT FORMATION RANBAXY LABORATORIES LIMITED (IN) 2004-11-23 — — US disclosed
EP-1419135-A1 PROCESS FOR THE PREPARATION OF TOLTERODINE RANBAXY LABORATORIES, LTD. (IN) 2004-05-19 — — EP disclosed
WO-2003014060-A1 PROCESS FOR THE PREPARATION OF TOLTERODINE RANBAXY LABORATORIES LIMITED (IN) 2003-02-20 — — WO 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 (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-20140039216-A1 PROCESS FOR PREPARING FESOTERODINE FES, QDPR, CYP4F3 KMT2A 4345/4885GAA 1412/4885ALDH1A1 1576/4885
US-20060094904-A1 Reacting methyl 3-(2-benzyloxy-5-methyl phenyl)-3-phenylpropionate with a reducing agent to form 3-(2-benzyloxy-5-methylphenyl)-3-phenylpropanol ADRB3, UGT1A3, COMT KMT2A 2338/4885GAA 1532/4885ALDH1A1 1360/4885
US-20040249211-A1 PROCESS FOR THE PREPARATION OF TOLTERODINE ADRB3, ADRA1B, ADRA2B KMT2A 4280/4885GAA 287/4885ALDH1A1 1876/4885
US-20120041235-A1 PROCESS FOR THE PREPARATION OF (R)-2-(3-DIISOPROPYLAMINO)-1-PHENYLPROPYL)-4METHYLPHENOL AND SALTS THEREOF PAH, UGT1A7, MLN KMT2A 4050/4885GAA 1407/4885ALDH1A1 663/4885
US-20060079716-A1 Process for the preparation of N,N-diisopropyl-3-(2-hydroxy-5-methylphenyl)-3-phenyl-propaneamine PNMT, INMT, DRD4 KMT2A 1033/4885GAA 4519/4885ALDH1A1 2072/4885

“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.

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