SCHEMBL9678100

SCHEMBL9678100

COc1ccc(CCN2CCC(S(=O)(=O)c3ccc(NS(C)(=O)=O)cc3)CC2)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.48
HTR2A P28223 3/20 0.48
HTR2C P28335 2/20 0.48
ABCB1 P08183 2/20 0.46
EBP Q15125 2/20 0.45
SIGMAR1 Q99720 2/20 0.45
TMEM97 Q5BJF2 1/20 0.45
HTR1A P08908 1/20 0.45
SLC6A4 P31645 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ADRA1A P35348 2/20 0.43
ADRA1B P35368 2/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL9444367 0.86 ABCB1 (0.61) ABCB1EBPSIGMAR1HTR1ASLC6A4
SCHEMBL9693115 0.84 KCNH2 (0.48) KCNH2HTR2AHTR2CABCB1HTR1A
SCHEMBL9681410 0.83 ABCB1 (0.43) KCNH2ABCB1EBPSIGMAR1TMEM97
SCHEMBL9447564 0.83 ABCB1 (0.45) KCNH2ABCB1EBPSIGMAR1TMEM97
SCHEMBL9041547 0.82 ABCB1 (0.43) KCNH2ABCB1EBPSIGMAR1TMEM97
SCHEMBL9444495 0.82 KCNH2 (0.58) KCNH2HTR2AHTR2CABCB1MEN1
Hydrochloric Acid SCHEMBL9444430 0.82 KCNH2 (0.59) KCNH2HTR2AHTR2CABCB1MEN1
SCHEMBL7026059 0.79 HTR2A (0.56) KCNH2HTR2AHTR2CABCB1TMEM97
SCHEMBL10512244 0.78 TMEM97 (0.46) KCNH2HTR2AHTR2CABCB1EBP
SCHEMBL10645360 0.78 KMT2A (0.54) ABCB1EBPSIGMAR1TMEM97MEN1

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