SCHEMBL9748155

SCHEMBL9748155

c1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.76
MAPK13 O15264 2/20 0.76
MAPK12 P53778 2/20 0.76
MAPK11 Q15759 2/20 0.76
KDM4E B2RXH2 4/20 0.74
TDP1 Q9NUW8 2/20 0.74
HPGD P15428 2/20 0.74
SMN1; SMN2 Q16637 2/20 0.74
CYP3A4 P08684 1/20 0.74
ALOX15 P16050 1/20 0.74
HSD17B10 Q99714 1/20 0.74
TGFBR1 P36897 1/20 0.55
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
ALDH1A1 P00352 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
MAPT P10636 2/20 0.53
GAA P10253 1/20 0.53
MAPK1 P28482 1/20 0.53
CYP1A2 P05177 1/20 0.52

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
SCHEMBL9436245 0.94 MAPK14 (0.84) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL11403139 0.93 MAPK14 (0.63) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL7378916 0.86 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL11502671 0.86 MAPK14 (0.76) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL146947 0.86 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11KDM4E
Ethylamine SCHEMBL11381979 0.86 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11KDM4E
Hydrochloric Acid SCHEMBL170802 0.85 KDM4E (1.00) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL11503150 0.84 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL11503168 0.84 MAPK14 (0.77) MAPK14MAPK13MAPK12MAPK11KDM4E
SCHEMBL9343464 0.83 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11KDM4E

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
EP-0203787-B1 Process for preparing pyridyl-substituted imidazo[2,1-b]thiazoles and thiazines SMITHKLINE BEECHAM CORPORATION (US) 1992-12-30 EP disclosed
US-5008390-A Compounds for preparing 6-phenyl-2,3-dihydroimidazo[2,1-b]-thiazoles and corresponding thiazines SMITHKLINE BECKMAN CORPORATION (US) 1991-04-16 US disclosed
US-4803279-A 1.4-dihydro-4-pyridyl-substituted imidazo (2,1-b) thiazoles and the corresponding thiazines. SMITHKLINE BECKMAN CORPORATION (US) 1989-02-07 US disclosed
EP-0203787-A2 Process for preparing pyridyl-substituted imidazo[2,1-b]thiazoles and thiazines SMITHKLINE BEECHAM CORPORATION (US) 1986-12-03 EP disclosed