SCHEMBL9563304

SCHEMBL9563304

CS(=O)(=O)Nc1ccccc1OCCCN1CCC(OC(c2ccsc2)c2ccsc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 0.41
PARP14 Q460N5 1/20 0.41
CHRM3 P20309 9/20 0.40
ADRB2 P07550 7/20 0.40
HTR1A P08908 2/20 0.39
DRD2 P14416 2/20 0.39
HTR2A P28223 2/20 0.39
HTR6 P50406 2/20 0.39
HTR7 P34969 1/20 0.39
NPC1 O15118 1/20 0.38
MLNR O43193 1/20 0.38
NR1I2 O75469 1/20 0.38
EGFR P00533 1/20 0.38
LMNA P02545 1/20 0.38
ERBB2 P04626 1/20 0.38
FYN P06241 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
ABCB1 P08183 1/20 0.38
ADRB1 P08588 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
SCHEMBL9565887 0.97 BCHE (0.45) BCHEPARP14CHRM3ADRB2HTR1A
SCHEMBL9563260 0.93 CHRM3 (0.39) BCHEPARP14CHRM3ADRB2HTR1A
SCHEMBL9563340 0.92 HTR1A (0.40) BCHEPARP14CHRM3ADRB2HTR1A
SCHEMBL9563263 0.89 BCHE (0.52) BCHEPARP14CHRM3HTR1ADRD2
SCHEMBL9563350 0.89 CHRM3 (0.39) BCHEPARP14CHRM3ADRB2HTR1A
Hydrochloric Acid SCHEMBL9563254 0.88 BCHE (0.51) BCHEPARP14CHRM3HTR1ADRD2
SCHEMBL9563241 0.86 BCHE (0.53) BCHEPARP14CHRM3ADRB2HTR1A
SCHEMBL9563179 0.86 BCHE (0.56) BCHEPARP14CHRM3ADRB2HTR1A
SCHEMBL9563231 0.86 DRD4 (0.37) CHRM3ADRB2HTR1AHTR7LMNA
SCHEMBL9563250 0.86 SCN8A (0.36) HTR1ALMNACHRM2ADRA2ACHRM1

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-0529365-A1 Diarylmethoxypiperidine derivatives Kaken Pharmaceutical Co., Ltd. (JP) 1993-03-03 EP claimed
US-5190959-A Antihistamines, antiallergens, treatment of ischemic heart disease KAKEN PHARMACEUTICAL CO. LTD. (JP) 1993-03-02 US claimed
EP-0529365-A1 Diarylmethoxypiperidine derivatives Kaken Pharmaceutical Co., Ltd. (JP) 1993-03-03 EP disclosed
US-5190959-A Antihistamines, antiallergens, treatment of ischemic heart disease KAKEN PHARMACEUTICAL CO. LTD. (JP) 1993-03-02 US disclosed