SCHEMBL9355448

SCHEMBL9355448

Cc1ncsc1CC(Cl)OS(=O)(=O)CCS(=O)(=O)OC(Cl)Cc1scnc1C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SLC6A3 Q01959 1/20 0.36
MAPT P10636 1/20 0.33
KAT2B Q92831 1/20 0.32
HPGD P15428 1/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL8931349 0.72 ALDH1A1 (0.55) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL8712755 0.71 ALDH1A1 (0.53) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL8604452 0.71 KDM4E (0.36) ALDH1A1KMT2AKDM4EMEN1LMNA
Hydrochloric Acid SCHEMBL9359007 0.69 ALDH1A1 (0.52) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL12919878 0.68 ALDH1A1 (0.53) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL1877529 0.66 ALDH1A1 (0.56) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL10667247 0.65 ALDH1A1 (0.50) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL28244029 0.65 ALDH1A1 (0.50) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL23141274 0.65 ALDH1A1 (0.55) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL26696056 0.65 ALDH1A1 (0.46) ALDH1A1KMT2AKDM4EMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0619734-A1 NEW PHARMACEUTICAL FORMULATIONS OF 5-(2-CHLORO-1-HYDROXYETHYL)-4-METHYLTHIAZOLE Astra Aktiebolag (SE) 1994-10-19 EP claimed
WO-1992003134-A1 NEW PHARMACEUTICAL FORMULATIONS OF 5-(2-CHLORO-1-HYDROXYETHYL)-4-METHYLTHIAZOLE AKTIEBOLAGET ASTRA (SE) 1992-03-05 WO claimed