SCHEMBL9000118

SCHEMBL9000118

O=C1NC(=O)C(S(=O)(=O)c2ccc3ccccc3c2)N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
LMNA P02545 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.41
AKR1B1 P15121 1/20 0.40
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
PKM P14618 1/20 0.39
F2 P00734 1/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
MCOLN3 Q8TDD5 3/20 0.38
KMT2A Q03164 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
AKR1C3 P42330 1/20 0.36
AKR1C1 Q04828 1/20 0.36

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
SCHEMBL8972696 0.80 MAPT (0.38) TSHRCA1CA2CA9ALDH1A1
SCHEMBL1219713 0.75 TSHR (0.46) TSHRLMNAL3MBTL1AKR1B1SLC6A2
SCHEMBL8799250 0.73 CA1 (0.45) TSHRAKR1B1F2PRSS1PRSS2
SCHEMBL29397944 0.72 LMNA (0.47) TSHRLMNAL3MBTL1AKR1B1F2
SCHEMBL144642 0.72 LMNA (0.47) TSHRLMNAL3MBTL1AKR1B1F2
SCHEMBL5275182 0.68 TSHR (0.59) TSHRLMNAL3MBTL1SLC6A2SLC6A4
SCHEMBL2829814 0.68 TDP1 (0.54) LMNASLC6A2SLC6A4KMT2AALDH1A1
SCHEMBL1952494 0.66 LMNA (0.68) TSHRLMNAL3MBTL1AKR1B1F2
SCHEMBL3212630 0.66 PKM (0.55) TSHRLMNAL3MBTL1SLC6A2SLC6A4
SCHEMBL6169176 0.65 ALDH1A1 (0.40) KMT2ACA1CA2CA9ALDH1A1

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
EP-0444546-B1 Hydantoin derivatives for use as hypoglycemic and/or hypolipidemic agents MOCHIDA PHARM CO LTD (JP) 1996-09-11 EP disclosed