SCHEMBL2369200

SCHEMBL2369200

CC(C)C(CCN)(c1ccccc1)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 11/20 0.45
TAAR1 Q96RJ0 3/20 0.43
CYP2D6 P10635 2/20 0.41
CYP1A2 P05177 1/20 0.41
KCNH2 Q12809 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
RIPK1 Q13546 1/20 0.38
KCNN4 O15554 1/20 0.38

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
SCHEMBL3642076 0.79 KIF11 (0.45) KIF11TAAR1CYP2D6CYP1A2KCNH2
Iodide SCHEMBL6672523 0.79 HTR2A (0.41) TAAR1CYP2D6CYP1A2KCNH2CYP3A4
SCHEMBL5221334 0.76 TAAR1 (0.54) KIF11TAAR1CYP2D6KCNH2CYP3A4
SCHEMBL702618 0.75 RIPK1 (0.35) KIF11TAAR1CYP2D6CYP1A2CYP2C19
SCHEMBL9064254 0.74 CYP2D6 (0.39) KIF11TAAR1CYP2D6CYP1A2KCNH2
SCHEMBL17906497 0.72 CHRNB2 (0.42) KIF11TAAR1CYP3A4CYP2C9
SCHEMBL706262 0.72 RIPK1 (0.33) KIF11CYP2D6CYP1A2KCNH2CYP2C19
SCHEMBL5147319 0.71 TAAR1 (0.67) KIF11TAAR1CYP2D6KCNH2CYP3A4
SCHEMBL12340194 0.71 LMNA (0.43) CYP2D6CYP1A2KCNN4
SCHEMBL1524876 0.70 KIF11 (0.54) KIF11TAAR1CYP2D6KCNH2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2545024-A1 SHORT SYNTHESIS OF TOLTERODINE, INTERMEDIATES AND METABOLITES LEK Pharmaceuticals d.d. (SI) 2013-01-16 EP disclosed
WO-2011110556-A1 SHORT SYNTHESIS OF TOLTERODINE, INTERMEDIATES AND METABOLITES LEK PHARMACEUTICALS D.D. (SI) 2011-09-15 WO disclosed
WO-2010092500-A2 A PROCESS FOR THE PREPARATION OF TOLTERODINE TARTRATE ALEMBIC LIMITED (IN) 2010-08-19 WO disclosed
WO-2010046801-A2 A PROCESS FOR THE PREPARATION OF TOLTERODINE TARTRATE ALEMBIC LIMITED (IN) 2010-04-29 WO disclosed
EP-1419135-A4 PROCESS FOR THE PREPARATION OF TOLTERODINE RANBAXY LAB LTD (IN) 2006-01-11 EP disclosed
EP-1603862-A1 3,3-DIARYLPROPYLAMINE DERIVATIVES AND PROCESSES FOR ISOLATION THEREOF Ranbaxy Laboratories Limited (IN) 2005-12-14 EP disclosed
WO-2004078700-A1 3,3-DIARYLPROPYLAMINE DERIVATIVES AND PROCESSES FOR ISOLATION THEREOF RANBAXY LABORATORIES LIMITED (IN) 2004-09-16 WO 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