SCHEMBL9048249

SCHEMBL9048249

Nc1ncc(Sc2ccncc2)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 2/20 0.46
DDAH1 O94760 1/20 0.46
MYC P01106 1/20 0.46
WDR5 P61964 1/20 0.46
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CDK2 P24941 1/20 0.35
LIMK1 P53667 1/20 0.35
DHFR P00374 2/20 0.34
TYMS P04818 2/20 0.34
PIK3CD O00329 2/20 0.33
PIK3CA P42336 2/20 0.33
PIK3CB P42338 2/20 0.33
PIK3CG P48736 2/20 0.33
LMNA P02545 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL9049940 0.83 ADORA3 (0.56) NOS1DDAH1MYCWDR5
SCHEMBL15587224 0.83 MYC (0.47) NOS1MYCWDR5ALDH1A1HPGD
SCHEMBL5171580 0.83 CYP3A4 (0.48) NOS1MYCWDR5ALDH1A1MEN1
SCHEMBL9048451 0.81 MYC (0.42) NOS1MYCWDR5KDM4ECDK2
SCHEMBL9426129 0.80 NR1H2 (0.45) NOS1MYCWDR5ALDH1A1HSD17B10
SCHEMBL9098198 0.80 MYC (0.59) NOS1MYCWDR5ALDH1A1HPGD
SCHEMBL9426921 0.76 POLB (0.51) MYCWDR5ALDH1A1KDM4EHPGD
SCHEMBL20583097 0.74 CDK2 (0.48) MYCWDR5ALDH1A1KDM4EHPGD
SCHEMBL9426795 0.74 PTGIR (0.42) MYCWDR5ALDH1A1KDM4EHPGD
SCHEMBL1060492 0.74 MAPT (0.54) MYCWDR5ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0412404-B1 Thiazole derivatives, processes for production thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1996-01-31 EP disclosed
CN-1027370-C Process for preparing thiazole derivatives FUJISAWA FARMACEUTICAL CO LTD (JP) 1995-01-11 CN disclosed
US-5369107-A Thiazole derivatives, processes for production thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-29 US disclosed
US-5256675-A Antirheumatic agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-10-26 US disclosed
CN-1049337-A Thiazole derivative prepares their method, and the medicinal compositions that contains them FUJISAWA PHARMACEUTICAL CO (JP) 1991-02-20 CN disclosed
EP-0412404-A2 Thiazole derivatives, processes for production thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-02-13 EP disclosed