SCHEMBL8799206

SCHEMBL8799206

COC(=O)NCC(=O)NS(=O)(=O)c1nc2ccccc2s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.54
CA2 P00918 6/20 0.54
ALDH1A1 P00352 3/20 0.48
PSMB8 P28062 1/20 0.46
PSMB5 P28074 1/20 0.46
MAPT P10636 3/20 0.45
CYP3A4 P08684 1/20 0.45
GAA P10253 1/20 0.45
CYP2C9 P11712 1/20 0.45
CA12 O43570 1/20 0.45
CA4 P22748 1/20 0.45
CA7 P43166 1/20 0.45
CA14 Q9ULX7 1/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
CSNK1D P48730 2/20 0.43
GLO1 Q04760 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALOX15 P16050 2/20 0.42
TSHR P16473 2/20 0.42

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
SCHEMBL8799536 0.80 CA1 (0.70) CA1CA2ALDH1A1PSMB8PSMB5
SCHEMBL10474248 0.78 PSMB8 (0.57) CA1CA2ALDH1A1PSMB8PSMB5
SCHEMBL6985918 0.74 SMN1; SMN2 (0.58) CA1CA2ALDH1A1PSMB8PSMB5
SCHEMBL29257742 0.73 PSMB8 (0.54) CA1CA2ALDH1A1PSMB8PSMB5
SCHEMBL8799542 0.72 CA1 (0.55) CA1CA2ALDH1A1PSMB8PSMB5
SCHEMBL10474769 0.72 PSMB8 (0.64) CA1CA2ALDH1A1PSMB8PSMB5
SCHEMBL8229512 0.72 PSMB8 (0.64) CA1CA2ALDH1A1PSMB8PSMB5
SCHEMBL31452859 0.71 TARS1 (0.61) CA1CA2ALDH1A1PSMB8PSMB5
SCHEMBL8973664 0.70 ATM (0.37) ALDH1A1SMN1; SMN2MEN1LMNAHTT
SCHEMBL31463118 0.70 PSMB8 (0.70) CA1CA2ALDH1A1PSMB8PSMB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0355827-B1 Hydantoin derivatives MOCHIDA PHARM CO LTD (JP) 1997-01-02 EP disclosed
WO-1990002126-A1 HYDANTOIN DERIVATIVES MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1990-03-08 WO disclosed
EP-0355827-A2 Hydantoin derivatives MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1990-02-28 EP disclosed