SCHEMBL9070866

SCHEMBL9070866

CC(C)Oc1cc(C(=O)Nc2nncs2)cc(OCc2ccccc2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
LMNA P02545 1/20 0.47
RAB9A P51151 1/20 0.46
GCK P35557 1/20 0.46
POLB P06746 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
AQP4 P55087 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
SCD O00767 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.41
TAAR1 Q96RJ0 1/20 0.40
NOX1 Q9Y5S8 2/20 0.40

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
SCHEMBL2667716 0.90 KDM4E (0.48) KDM4ELMNARAB9AGCKPOLB
SCHEMBL9070916 0.90 ALDH1A1 (0.45) KDM4ELMNARAB9AGCKPOLB
SCHEMBL2667626 0.89 NOX1 (0.49) KDM4ELMNARAB9AGCKPOLB
SCHEMBL9070883 0.89 NOX1 (0.49) KDM4ELMNARAB9AGCKPOLB
SCHEMBL9070891 0.89 NOX1 (0.49) KDM4ELMNARAB9AGCKPOLB
SCHEMBL2667656 0.89 KDM4E (0.43) KDM4ELMNARAB9APOLBMEN1
SCHEMBL2667707 0.88 RAB9A (0.44) KDM4ELMNARAB9AGCKAQP4
SCHEMBL2667653 0.88 GCK (0.49) KDM4ELMNARAB9AGCKAQP4
SCHEMBL2667598 0.85 NPC1 (0.53) KDM4ERAB9AGCKSCDHPGD
SCHEMBL9070867 0.84 SCD (0.56) RAB9AGCKSCDHPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009083553-A1 AZINE COMPOUNDS AS GLUCOKINASE ACTIVATORS RHEOSCIENCE A/S (DK) 2009-07-09 WO disclosed