SCHEMBL9447437

SCHEMBL9447437

CCN(CCCC(=O)c1ccc(NS(C)(=O)=O)cc1)CCc1cccc(C)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 4/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ KDM4E B2RXH2 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CACNA1F O60840 1/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ ADRA2B P18089 1/20 0.41
▸ ADRA2C P18825 1/20 0.41
▸ CHRM3 P20309 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ SLC6A4 P31645 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ CACNA1D Q01668 1/20 0.41
▸ CACNA1S Q13698 1/20 0.41
▸ CACNA1C Q13936 1/20 0.41
▸ HPGD P15428 2/20 0.40
▸ RECQL P46063 1/20 0.40

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
SCHEMBL9447468 0.89 KCNH2 (0.52) KCNH2CYP3A4CYP2D6CYP2C19KDM4E
SCHEMBL9678401 0.86 KCNH2 (0.52) KCNH2CYP3A4CYP2D6CYP2C19KDM4E
SCHEMBL9676515 0.85 KCNH2 (0.54) KCNH2CYP3A4CYP2D6CYP2C19KDM4E
SCHEMBL9678090 0.84 KCNH2 (0.52) KCNH2CYP3A4CYP2D6CYP2C19KDM4E
SCHEMBL9447556 0.82 KCNH2 (0.64) KCNH2CYP3A4CYP2D6CYP2C19KDM4E
SCHEMBL9677412 0.81 KCNH2 (0.55) KCNH2CYP3A4CYP2D6CYP2C19KDM4E
SCHEMBL9447432 0.78 KCNH2 (0.53) KCNH2CYP3A4CYP2D6CYP2C19KDM4E
SCHEMBL9625720 0.74 CACNA1F (0.64) KCNH2KDM4ECACNA1FCHRM2ADRA2B
Hydrochloric Acid SCHEMBL9625546 0.73 CACNA1F (0.63) KCNH2KDM4ECACNA1FCHRM2ADRA2B
SCHEMBL9692733 0.72 KCNH2 (0.50) KCNH2CYP3A4CYP2D6CYP2C19KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5246946-A Antiarrhythmia agents and cardiovascular disorders EISAI CO., LTD. (JP) 1993-09-21 — — US disclosed
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
Send feedback