SCHEMBL9836233

SCHEMBL9836233

CC(C)(C)CC(=O)Nc1nc(CCl)cs1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.66
KMT2A Q03164 2/20 0.66
ALDH1A1 P00352 5/20 0.53
HPGD P15428 3/20 0.47
PDE5A O76074 7/20 0.46
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 1/20 0.44
PKM P14618 1/20 0.44
RAB9A P51151 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GAA P10253 1/20 0.44
MEN1 O00255 1/20 0.44
PDE1A P54750 2/20 0.43
PDE1B Q01064 2/20 0.43
PDE1C Q14123 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPT P10636 1/20 0.42
GFER P55789 1/20 0.42
CDK5 Q00535 1/20 0.42
CDK5R1 Q15078 1/20 0.42

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
SCHEMBL12597160 0.85 ALDH1A1 (0.50) SMN1; SMN2KMT2AALDH1A1HPGDPDE5A
SCHEMBL9677782 0.83 SMN1; SMN2 (0.71) SMN1; SMN2KMT2AALDH1A1HPGDPDE5A
SCHEMBL69505 0.82 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AALDH1A1HPGDNPC1
SCHEMBL9835391 0.81 SMN1; SMN2 (0.68) SMN1; SMN2KMT2AALDH1A1PDE5AKDM4E
SCHEMBL12921418 0.80 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1KDM4ENPC1RAB9A
SCHEMBL307301 0.80 SMN1; SMN2 (1.00) SMN1; SMN2KMT2AALDH1A1KDM4ENPC1
SCHEMBL77191 0.79 ALDH1A1 (0.63) SMN1; SMN2KMT2AALDH1A1HPGDKDM4E
SCHEMBL9836846 0.78 PDE5A (0.64) SMN1; SMN2KMT2AALDH1A1HPGDPDE5A
SCHEMBL356279 0.78 SMN1; SMN2 (0.64) SMN1; SMN2KMT2AALDH1A1HPGDNPC1
SCHEMBL353851 0.78 SMN1; SMN2 (0.73) SMN1; SMN2KMT2AALDH1A1HPGDPDE5A

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
EP-0224919-B1 NEW THIAZOLE COMPOUNDS, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-08-14 EP disclosed
US-4742057-A Antiallergic thiazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-05-03 US disclosed
EP-0224919-A2 New thiazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-10 EP disclosed