SCHEMBL11000007

SCHEMBL11000007

Nc1c(-c2cccs2)nsc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 6/20 0.46
MAPT P10636 3/20 0.44
GAA P10253 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
RPS6KB2 Q9UBS0 2/20 0.43
SRPK1 Q96SB4 1/20 0.43
ADORA2A P29274 1/20 0.41
PLAU P00749 1/20 0.41
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 2/20 0.39
MCL1 Q07820 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL10998752 0.82 KDM4E (0.56) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL11003366 0.77 ALDH1A1 (0.47) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL5156927 0.76 MEN1 (0.47) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL10268828 0.72 KDM4E (0.49) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL11003497 0.70 RAB9A (0.47) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL11003416 0.70 ALDH1A1 (0.53) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL10994400 0.70 KDM4E (0.64) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL10994158 0.70 MAPT (0.47) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL8842879 0.70 MKNK1 (0.48) ALDH1A1KDM4EMAPTGAAHSD17B10
SCHEMBL10999458 0.70 MKNK1 (0.47) MEN1KMT2AALDH1A1MAPTGAA

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
US-4544752-A TREATMENT OF GOUT; ANTIARTHRITIC AGENTS ELI LILLY AND COMPANY (US) 1985-10-01 US disclosed
EP-0048615-B1 IMPROVEMENTS IN OR RELATING TO 3-ARYL-5-ISOTHIAZOLE DERIVATIVES ELI LILLY AND COMPANY (US) 1984-05-30 EP disclosed
US-4346094-A ENZYME INHIBITORS ELI LILLY AND COMPANY (US) 1982-08-24 US disclosed
EP-0048615-A1 Improvements in or relating to 3-aryl-5-isothiazole derivatives ELI LILLY AND COMPANY (US) 1982-03-31 EP disclosed