SCHEMBL8931380

SCHEMBL8931380

CC(=O)C(CC(C)Cl)SC#N

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL1069137 0.84 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL8931335 0.81 ALDH1A1 (0.33) ALDH1A1
SCHEMBL8931363 0.74
SCHEMBL8931542 0.72 ALDH1A1 (0.30) ALDH1A1MAPT
SCHEMBL2845662 0.68
SCHEMBL27459059 0.66 DPP4 (0.35) ALDH1A1MAPT
SCHEMBL8931332 0.65
SCHEMBL28846249 0.65 ALDH1A1 (0.34) ALDH1A1MAPT
SCHEMBL27710857 0.63 ALDH1A1 (0.35) ALDH1A1MAPT
SCHEMBL11875333 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 7 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
US-5534644-A Process for the preparation of 4-methyl-5-(2-chloroethyl)-thiazole and analogues thereof AKTIEBOLAGET ASTRA (SE) 1996-07-09 US disclosed
EP-0619815-A1 NOVEL PROCESS FOR THE PREPARATION OF 4-METHYL-5-(2-CHLOROETHYL)-THIAZOLE AND ANALOGUES THEREOF. ASTRA AB (SE) 1994-10-19 EP disclosed
EP-0546306-A1 5-(2-Chloroalkyl)-4-methylthiazoles, their preparation and their use, and intermediates for their preparation Astra Aktiebolag (SE) 1993-06-16 EP disclosed
WO-1993009107-A1 NOVEL PROCESS FOR THE PREPARATION OF 4-METHYL-5-(2-CHLOROETHYL)-THIAZOLE AND ANALOGUES THEREOF AKTIEBOLAGET ASTRA (SE) 1993-05-13 WO disclosed