SCHEMBL8931350

SCHEMBL8931350

CC(=O)C1(Cl)CC(C)OC1=O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.34
AKR1B1 P15121 10/20 0.33

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
SCHEMBL8931354 0.77 HTR7 (0.32) AKR1B1
SCHEMBL981185 0.69
SCHEMBL5346800 0.67
SCHEMBL441723 0.66
SCHEMBL28476837 0.65 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL9099166 0.65 ALDH1A1 (0.31)
SCHEMBL12616582 0.64 SMN1; SMN2 (0.39) SMN1; SMN2
SCHEMBL263371 0.64 ALDH1A1 (0.35)
SCHEMBL11100164 0.64 SMN1; SMN2 (0.34) SMN1; SMN2AKR1B1
SCHEMBL20079554 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5648498-A Process for the preparation of 4-methyl-5-(2-chloroethyl)-thiazole and analogues thereof ASTRA AKTIEBOLAG (SE) 1997-07-15 US disclosed
EP-0546306-B1 5-(2-Chloroalkyl)-4-methylthiazoles, their preparation and their use, and intermediates for their preparation ASTRA AB (SE) 1997-04-16 EP disclosed
EP-0619815-B1 PROCESS FOR THE PREPARATION OF 4-METHYL-5-(2-CHLOROETHYL)-THIAZOLE AND ANALOGUES THEREOF ASTRA AB (SE) 1997-04-16 EP disclosed