SCHEMBL9045577

SCHEMBL9045577

Cc1ccnc(Sc2cnc(N)s2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.42
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 2/20 0.41
MYC P01106 1/20 0.40
WDR5 P61964 1/20 0.40
NOS1 P29475 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
NPC1 O15118 3/20 0.38
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
BACE1 P56817 1/20 0.34
CDK2 P24941 1/20 0.34
POLB P06746 1/20 0.33
CASP3 P42574 1/20 0.33
GFER P55789 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 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
SCHEMBL9050678 0.84 MYC (0.42) MYCWDR5NOS1BACE1CDK2
SCHEMBL9047603 0.81 MYC (0.40) MYCWDR5NOS1CDK2
SCHEMBL1607000 0.78 MYC (0.48) RAB9AALDH1A1MYCWDR5NOS1
SCHEMBL9049316 0.74 CCNE1 (0.50) CDK2
SCHEMBL702948 0.73
SCHEMBL9098198 0.73 MYC (0.59) ALDH1A1MYCWDR5NOS1SMN1; SMN2
SCHEMBL3839683 0.71 CYP3A4 (0.46) RAB9AALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL28436563 0.69 MYC (0.43) RAB9AALDH1A1MYCWDR5NOS1
SCHEMBL9048819 0.69 MYC (0.40) MYCWDR5NOS1SMN1; SMN2BACE1
SCHEMBL9048249 0.68 NOS1 (0.46) ALDH1A1KMT2AMYCWDR5NOS1

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-0412404-B1 Thiazole derivatives, processes for production thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1996-01-31 EP 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
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