SCHEMBL9629138

SCHEMBL9629138

CNCCOc1ccc(C(=O)NC)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 3/20 0.73
NPC1 O15118 4/20 0.59
TSHR P16473 2/20 0.59
HTT P42858 2/20 0.59
HPGD P15428 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
TBXAS1 P24557 1/20 0.55
HTR1D P28221 1/20 0.55
HTR1B P28222 1/20 0.55
MMP13 P45452 1/20 0.53
MAPT P10636 1/20 0.51
USP2 O75604 1/20 0.51
ALOX15 P16050 1/20 0.51
MAPK1 P28482 1/20 0.51
HSD17B10 Q99714 1/20 0.51
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL4039677 0.88 NPC1 (0.58) PLK1NPC1TSHRHTTHTR1D
SCHEMBL25581165 0.85 NPC1 (0.55) PLK1NPC1TSHRHTTHPGD
SCHEMBL12502459 0.85 NPC1 (0.68) PLK1NPC1TSHRHTTHPGD
SCHEMBL4751615 0.84 PLK1 (0.75) PLK1NPC1TSHRHTTHPGD
SCHEMBL10065842 0.84 TSHR (0.71) NPC1TSHRHTTHTR1DHTR1B
SCHEMBL4751488 0.84 PLK1 (0.75) PLK1NPC1TSHRHTTHPGD
SCHEMBL5141541 0.84 L3MBTL1 (0.70) PLK1NPC1TSHRHPGDSMN1; SMN2
SCHEMBL11962158 0.84 PLK1 (1.00) PLK1NPC1TSHRHTTHPGD
SCHEMBL12839873 0.84 PLK1 (0.87) PLK1NPC1TSHRHTTHPGD
SCHEMBL24600195 0.84 NPC1 (0.66) PLK1NPC1HTTHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0245997-B1 N-SUBSTITUTED P-AMINOETHYLSULPHON ANILIDES AS ANTIARRHYTHMIC AGENTS, AND INTERMEDIATES THEREFOR Pfizer Limited (GB) 1992-04-15 EP disclosed
US-5079248-A Antifibrillatory agents; side effect reduction PFIZER INC. (US) 1992-01-07 US disclosed
US-4959366-A Anti-arrhythmic agents PFIZER INC. (US) 1990-09-25 US disclosed
EP-0245997-A2 N-substituted p-aminoethylsulphon anilides as antiarrhythmic agents, and intermediates therefor Pfizer Limited (GB) 1987-11-19 EP disclosed