SCHEMBL9677488

SCHEMBL9677488

CS(=O)(=O)Nc1ccc(S(=O)(=O)C2CCN(CCc3cccnc3)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.55
HTR2A P28223 4/20 0.55
HTR2C P28335 2/20 0.55
NAMPT P43490 6/20 0.48
ALDH1A1 P00352 1/20 0.46
HRH3 Q9Y5N1 1/20 0.45
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
ROCK2 O75116 2/20 0.42
HSD11B1 P28845 1/20 0.41

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
SCHEMBL9444379 0.84 CCR3 (0.49) HTR2AALDH1A1
SCHEMBL9676471 0.83 ALDH1A1 (0.44) KCNH2NAMPTALDH1A1HRH3CYP3A4
SCHEMBL9447542 0.83 ALDH1A1 (0.45) KCNH2NAMPTALDH1A1HRH3CYP3A4
SCHEMBL9444455 0.82 KCNH2 (0.65) KCNH2HTR2AHTR2CNAMPTALDH1A1
Hydrochloric Acid SCHEMBL9444345 0.81 KCNH2 (0.65) KCNH2HTR2AHTR2CNAMPTALDH1A1
SCHEMBL9444499 0.79 KCNH2 (0.58) KCNH2HTR2AHTR2CNAMPTALDH1A1
SCHEMBL9678360 0.78 KCNH2 (0.69) KCNH2HTR2AHTR2CNAMPTCYP3A4
SCHEMBL9678100 0.77 KCNH2 (0.48) KCNH2HTR2AHTR2CALDH1A1
SCHEMBL9444439 0.77 KCNH2 (0.60) KCNH2HTR2ANAMPTALDH1A1CYP3A4
SCHEMBL9444290 0.76 KCNH2 (0.59) KCNH2HTR2ANAMPTALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0304888-B1 SULFONAMIDOLPHENYL DERIVATES AND THERAPEUTIC AND PREVENTIVE AGENTS FOR ARRYTHMIA CONTAINING SAME Eisai Co., Ltd. (JP) 1992-11-11 EP disclosed
US-5162347-A Piperidine derivatives and therapeutic and preventive agents for arrhythmia containing same EISAI CO., LTD. (JP) 1992-11-10 US disclosed
US-5082850-A PIPERIDINE DERIVATIVES AND THERAPEUTIC AND PREVENTIVE AGENTS FOR ARRHYTHMIA CONTAINING SAME EISAI CO., LTD. (JP) 1992-01-21 US disclosed
US-4977165-A Piperidine derivative and therapeutic and preventive agents for arrhythmia containing same EISAI CO., LTD. (JP) 1990-12-11 US disclosed
EP-0304888-A1 Sulfonamidolphenyl derivates and therapeutic and preventive agents for arrythmia containing same Eisai Co., Ltd. (JP) 1989-03-01 EP disclosed