SCHEMBL27963558

SCHEMBL27963558

NC(=O)C(CCBr)(c1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 10/20 0.55
CHRM2 P08172 7/20 0.55
KCNH2 Q12809 2/20 0.55
CHRM1 P11229 2/20 0.55
LMNA P02545 1/20 0.55
CYP2D6 P10635 1/20 0.55
KDM4E B2RXH2 1/20 0.54
CTDSP1 Q9GZU7 1/20 0.54
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
OPRM1 P35372 2/20 0.45
DRD3 P35462 2/20 0.45
DRD2 P14416 1/20 0.45
HTT P42858 1/20 0.43
SLC22A2 O15244 1/20 0.43
SLC22A1 O15245 1/20 0.43
PGR P06401 1/20 0.43
THRB P10828 1/20 0.43
ADRB3 P13945 1/20 0.43
OPRK1 P41145 1/20 0.43

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
SCHEMBL395172 0.84 CYP1A2 (0.43) CHRM3CHRM2KCNH2CHRM1LMNA
SCHEMBL10685798 0.84 CHRM3 (0.50) CHRM3CHRM2KCNH2CHRM1LMNA
SCHEMBL10524246 0.82 CHRM3 (0.57) CHRM3CHRM2KCNH2CHRM1LMNA
Hydrochloric Acid SCHEMBL2395810 0.82 OPRM1 (0.42) CHRM3CHRM2KCNH2CHRM1LMNA
SCHEMBL10392372 0.81 CHRM3 (0.55) CHRM3CHRM2KCNH2CHRM1LMNA
SCHEMBL9295790 0.81 CHRM3 (0.59) CHRM3CHRM2KCNH2CHRM1LMNA
SCHEMBL4153935 0.81 CHRM3 (0.55) CHRM3CHRM2KCNH2CHRM1LMNA
SCHEMBL2395807 0.81 OPRM1 (0.41) CHRM3CHRM2KCNH2CHRM1LMNA
SCHEMBL4138872 0.79 CHRM3 (0.54) CHRM3CHRM2KCNH2CHRM1LMNA
SCHEMBL17749475 0.78 CHRM3 (0.53) CHRM3CHRM2KCNH2CHRM1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103772286-B A kind of method preparing imidafenacin JIANGXI QINGFENG PHARMACEUTICAL CO., LTD. (CN) 2016-01-13 CN claimed
CN-103772286-A Method for preparing imidafenacin JIANGXI QINGFENG PHARMACEUTICAL CO LTD 2014-05-07 CN claimed
CN-103772286-A Method for preparing imidafenacin JIANGXI QINGFENG PHARMACEUTICAL CO LTD 2014-05-07 CN disclosed