SCHEMBL9690274

SCHEMBL9690274

CN(CCc1ccc2ccccc2n1)CC(=O)c1ccc(NS(C)(=O)=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 4/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ KCNH2 Q12809 3/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ PTGS2 P35354 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HDAC3 O15379 2/20 0.39
▸ HDAC4 P56524 2/20 0.39
▸ HDAC1 Q13547 2/20 0.39
▸ HDAC7 Q8WUI4 2/20 0.39
▸ HDAC2 Q92769 2/20 0.39
▸ HDAC10 Q969S8 2/20 0.39

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
SCHEMBL9677412 0.85 KCNH2 (0.55) MEN1KMT2AKCNH2CYP2D6PTGS2
Hydrochloric Acid SCHEMBL9689700 0.82 KCNH2 (0.54) PDE10AKCNH2CYP2D6CYP3A4CYP2C19
SCHEMBL9690235 0.77 MTNR1A (0.46) KCNH2PTGS2HDAC3HDAC4HDAC1
SCHEMBL9676515 0.75 KCNH2 (0.54) MEN1KMT2AKCNH2CYP2D6PTGS2
SCHEMBL9689736 0.75 BRPF1 (0.40) MEN1KMT2AKCNH2PTGS2CYP1A2
SCHEMBL9447468 0.74 KCNH2 (0.52) MEN1KMT2AKCNH2CYP2D6PTGS2
SCHEMBL9689716 0.73 NR3C2 (0.56) PTGS2KDM4ENR3C2ACHE
SCHEMBL9678401 0.73 KCNH2 (0.52) MEN1KMT2AKCNH2CYP2D6PTGS2
SCHEMBL9689271 0.72 RAB9A (0.49) MEN1KMT2ACYP2C19CYP2C9POLB
SCHEMBL9689654 0.71 HTR6 (0.41) MEN1KMT2AKDM4EPOLB

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
US-5114952-A Side effect reduction PFIZER INC. (US) 1992-05-19 — — US disclosed
US-4990509-A Sulfonamide anti-arrhythmic agents PFIZER INC. (US) 1991-02-05 — — US disclosed
US-4863948-A Isoindolinone sulfonamide anti-arrhythmic agents PFIZER, INC. (US) 1989-09-05 — — US disclosed
EP-0242173-A1 Antiarrhythmic agents Pfizer Limited (GB) 1987-10-21 — — EP disclosed
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