SCHEMBL13257883

SCHEMBL13257883

Cc1ccc(OCc2ccccc2)c([C@H](CC(=O)N(C(C)C)C(C)C)c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
HTT P42858 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
GAA P10253 2/20 0.47
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
PTGER1 P34995 3/20 0.43
PTGER4 P35408 3/20 0.43
PTGER3 P43115 3/20 0.43
PTGER2 P43116 3/20 0.43
MRGPRX4 Q96LA9 3/20 0.42
FFAR4 Q5NUL3 2/20 0.40
LMNA P02545 2/20 0.40
LRRK2 Q5S007 1/20 0.40
ALOX5 P09917 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CHRM2 P08172 2/20 0.40
CHRM5 P08912 2/20 0.40
CHRM1 P11229 2/20 0.40
CHRM3 P20309 2/20 0.40

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
SCHEMBL12986736 1.00 KMT2A (0.47) KMT2AHTTNPSR1GAAALDH1A1
SCHEMBL1991544 0.93 KMT2A (0.40) KMT2AHTTNPSR1GAAALDH1A1
SCHEMBL2167293 0.88 LMNA (0.47) KMT2ANPSR1ALDH1A1MEN1PTGER1
SCHEMBL14830823 0.88 LMNA (0.47) KMT2ANPSR1ALDH1A1MEN1PTGER1
SCHEMBL2167132 0.88 LMNA (0.47) KMT2ANPSR1ALDH1A1MEN1PTGER1
SCHEMBL1991102 0.87 KMT2A (0.43) KMT2AHTTNPSR1GAAALDH1A1
SCHEMBL9222660 0.86 KMT2A (0.50) KMT2AHTTNPSR1GAAALDH1A1
SCHEMBL1990348 0.86 PTGER1 (0.51) KMT2AHTTNPSR1GAAPTGER1
SCHEMBL1990350 0.86 PTGER1 (0.51) KMT2AHTTNPSR1GAAPTGER1
SCHEMBL13196102 0.86 KMT2A (0.51) KMT2AHTTNPSR1GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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