SCHEMBL9749415

SCHEMBL9749415

CCCCCc1nc2n(c1-c1ccncc1)CCS2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.52
MAPK13 O15264 2/20 0.52
MAPK12 P53778 2/20 0.52
MAPK11 Q15759 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
CYP3A4 P08684 2/20 0.51
KDM4E B2RXH2 2/20 0.51
HPGD P15428 1/20 0.51
ALOX15 P16050 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
TGFBR1 P36897 1/20 0.38
TNKS2 Q9H2K2 1/20 0.36
MAPT P10636 4/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
NFKB1 P19838 2/20 0.35
NFKB2 Q00653 2/20 0.35
RELA Q04206 2/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL9747245 0.78 POLB (0.40) SMN1; SMN2HPGDMAPTNPC1RAB9A
SCHEMBL9436245 0.75 MAPK14 (0.84) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2
SCHEMBL11502953 0.73 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2
SCHEMBL11502671 0.71 MAPK14 (0.76) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2
SCHEMBL7378916 0.68 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2
SCHEMBL9343464 0.68 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2
SCHEMBL7369791 0.68 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2
SCHEMBL9340169 0.68 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2
SCHEMBL9839472 0.68 POLB (0.31) SMN1; SMN2LMNAPOLB
SCHEMBL11503168 0.67 MAPK14 (0.77) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2

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