SCHEMBL9098317

SCHEMBL9098317

CSc1ccc2nc(Sc3cnc(N)s3)ccc2c1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.35
WDR5 P61964 1/20 0.35
TYMS P04818 1/20 0.34
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PI4KA P42356 1/20 0.33
PIK3CG P48736 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
BACE1 P56817 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
CASP6 P55212 1/20 0.33
KEAP1 Q14145 1/20 0.32
CDK2 P24941 1/20 0.30
NOS1 P29475 1/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL9097754 0.85 BACE1 (0.46) MYCWDR5PIK3CDPIK3CAPIK3CB
SCHEMBL9099767 0.83 BACE1 (0.46) MYCWDR5TYMSPIK3CDPIK3CA
SCHEMBL9097135 0.79 NCF1 (0.41) MYCWDR5BACE1KDM4E
SCHEMBL28443457 0.70 SMN1; SMN2 (0.45) MYCWDR5TYMSKDM4ELMNA
SCHEMBL9099215 0.69 HPGD (0.54) MYCWDR5KDM4ELMNAPOLB
SCHEMBL9099400 0.69 MYC (0.37) MYCWDR5KDM4ELMNA
SCHEMBL702948 0.67
SCHEMBL9098198 0.67 MYC (0.59) MYCWDR5BACE1POLBCDK2
SCHEMBL5171580 0.67 CYP3A4 (0.48) MYCWDR5CDK2NOS1
SCHEMBL1913966 0.64 KCNH2 (0.64) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG

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-1996030370-A2 THIAZOLE AND THIADIAZOLE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS USEFUL IN THE TREATMENT OF THROMBOCYTOPENIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-03 WO disclosed