SCHEMBL6499356

SCHEMBL6499356

CS(=O)(=O)Nc1ccc(C(O)CCl)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.65
ADRB3 P13945 4/20 0.65
KDM4E B2RXH2 3/20 0.65
ADRB2 P07550 2/20 0.65
ADRB1 P08588 2/20 0.65
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
GLA P06280 1/20 0.63
BLM P54132 1/20 0.63
ADRA2C P18825 2/20 0.52
CACNA1F O60840 1/20 0.52
CHRM2 P08172 1/20 0.52
ADRA2B P18089 1/20 0.52
CHRM3 P20309 1/20 0.52
HTR2A P28223 1/20 0.52
SLC6A4 P31645 1/20 0.52
DRD3 P35462 1/20 0.52
CACNA1D Q01668 1/20 0.52
KCNH2 Q12809 1/20 0.52
CACNA1S Q13698 1/20 0.52

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
SCHEMBL9447441 0.83 LMNA (0.65) LMNAADRB3KDM4EADRB2ADRB1
SCHEMBL6074384 0.83 ADRB3 (0.65) LMNAADRB3KDM4EADRB2ADRB1
SCHEMBL6075074 0.83 LMNA (0.65) LMNAADRB3KDM4EADRB2ADRB1
SCHEMBL7243938 0.83 ADRB3 (0.65) LMNAADRB3KDM4EADRB2ADRB1
SCHEMBL9445125 0.83 ADRB3 (0.65) LMNAADRB3KDM4EADRB2ADRB1
SCHEMBL6074523 0.83 LMNA (0.65) LMNAADRB3KDM4EADRB2ADRB1
SCHEMBL7106207 0.82 PNMT (0.48) LMNAADRB3KDM4EADRB2ADRB1
SCHEMBL7452691 0.82 LMNA (0.64) LMNAADRB3KDM4EADRB2ADRB1
SCHEMBL9688351 0.81 ADRB2 (0.72) LMNAADRB3KDM4EADRB2ADRB1
SCHEMBL7244119 0.80 ADRB3 (0.61) LMNAADRB3KDM4EADRB2ADRB1

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
US-6888012-B2 Reducing an alpha -haloketone compound by asymmetric hydrogen transfer in presence of a group 9 transition metal compound having a substituted or unsubstituted cyclopentadienyl group and an optically active diamine compound AJINOMOTO CO., INC. (JP) 2005-05-03 US disclosed
EP-1346972-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE HALOHYDRIN COMPOUND Ajinomoto Co., Inc. (JP) 2003-09-24 EP disclosed