SCHEMBL9100796

SCHEMBL9100796

c1ccc(Sc2cnc(Sc3ccccn3)s2)nc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.45
EHMT1 Q9H9B1 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.43
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 5/20 0.40
NPSR1 Q6W5P4 3/20 0.40
MAPT P10636 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
USP2 O75604 2/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
NPC1 O15118 6/20 0.38
RAB9A P51151 6/20 0.38
HTT P42858 3/20 0.38
S1PR4 O95977 1/20 0.38
HSP90AA1 P07900 1/20 0.38
S1PR1 P21453 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL211069 0.81 EHMT2 (0.44) EHMT2EHMT1APOBEC3GL3MBTL1KDM4E
SCHEMBL9098687 0.81 L3MBTL1 (0.50) EHMT2EHMT1APOBEC3GL3MBTL1KDM4E
Hydrochloric Acid SCHEMBL9047937 0.79 L3MBTL1 (0.45) EHMT2EHMT1APOBEC3GL3MBTL1KDM4E
SCHEMBL9099196 0.77 EHMT2 (0.40) EHMT2EHMT1APOBEC3GL3MBTL1KDM4E
SCHEMBL2733133 0.77 EHMT2 (0.40) EHMT2EHMT1APOBEC3GL3MBTL1KDM4E
SCHEMBL2655172 0.76 ICAM1 (0.50) EHMT2EHMT1APOBEC3GL3MBTL1KDM4E
SCHEMBL15540975 0.73 HPGDS (0.48) L3MBTL1KDM4EALDH1A1MEN1KMT2A
SCHEMBL301719 0.73 EHMT2 (0.70) EHMT2EHMT1APOBEC3GL3MBTL1KDM4E
SCHEMBL9098150 0.71 GRM4 (0.47) EHMT2EHMT1APOBEC3GL3MBTL1NPC1
SCHEMBL9097574 0.71 GRM4 (0.44) EHMT2EHMT1APOBEC3GL3MBTL1ALDH1A1

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