SCHEMBL6828491

SCHEMBL6828491

CCCc1cc(=O)[nH]nc1-c1sc(C(=O)NC2CC2)nc1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.42
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
KDR P35968 1/20 0.38
PLK1 P53350 1/20 0.38
CCNA1 P78396 1/20 0.38
DCLK1 O15075 1/20 0.37
PDPK1 O15530 1/20 0.37
PRKD3 O94806 1/20 0.37
MAP4K4 O95819 1/20 0.37
CHEK2 O96017 1/20 0.37
PIM1 P11309 1/20 0.37
MAPK1 P28482 1/20 0.37
AXL P30530 1/20 0.37
FLT4 P35916 1/20 0.37
FLT3 P36888 1/20 0.37
MAPK9 P45984 1/20 0.37
CSNK1D P48730 1/20 0.37
IRAK1 P51617 1/20 0.37
RPS6KA3 P51812 1/20 0.37

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
SCHEMBL6828673 0.93 MAPK8 (0.44) MAPK8CCNA2CDK2KDRPLK1
SCHEMBL6828736 0.85 MAPK8 (0.46) MAPK8CCNA2CDK2KDRPLK1
SCHEMBL6829284 0.83 MAPK8 (0.43) MAPK8CCNA2CDK2KDRPLK1
SCHEMBL6134270 0.78 MAPK8 (0.51) MAPK8CCNA2CDK2KDRPLK1
SCHEMBL6828465 0.77 HPGD (0.41) RAB9AHPGDKDM4EALDH1A1
SCHEMBL6830662 0.77 ADORA3 (0.41) MAPK1RAB9AHPGDSMN1; SMN2KDM4E
SCHEMBL6828733 0.76 HPGDS (0.47) DHODHMEN1KMT2AHPGDKDM4E
SCHEMBL8833929 0.75 HPGD (0.55) CLK4RAB9ATP53HPGDNPC1
SCHEMBL6829904 0.74 NPC1 (0.39) MAPK1CNR1CNR2RAB9ATP53
SCHEMBL6133697 0.71 HSD17B10 (0.46) MAPK1CNR1CNR2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1441732-A2 THIAZOLE DERIVATIVE AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-04 EP disclosed
WO-2003039451-A2 THIAZOLE PYRIDAZINONES AS ADENOSINE ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-05-15 WO disclosed