SCHEMBL8950361

SCHEMBL8950361

COC(=O)C1=Cc2ccsc2S(=O)(=O)N1c1ccc(OC)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
MAPT P10636 4/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 2/20 0.38
MAPK10 P53779 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
TSHR P16473 2/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 6/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 1/20 0.36
MAPK8 P45983 1/20 0.36
MAPK9 P45984 1/20 0.36
MEN1 O00255 4/20 0.36
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL8950606 0.80 CA2 (0.36) LMNAMAPTMAPK10ALDH1A1CA2
SCHEMBL9115098 0.73 LMNA (0.41) LMNAMAPTKDM4EHPGDMAPK10
SCHEMBL8950076 0.71 FEN1 (0.46) LMNAMAPTKDM4EHPGDMAPK10
SCHEMBL8950208 0.71 CA2 (0.33) CA2
SCHEMBL8950271 0.71 CYP4A11 (0.34) LMNAKMT2AL3MBTL1POLB
SCHEMBL20487232 0.58 MEN1 (0.74) MAPTKMT2AMEN1TDP1TP53
SCHEMBL10516113 0.57 NPC1 (0.73) LMNAMAPTKDM4EHPGDNPSR1
SCHEMBL15004854 0.57 MAPK1 (0.58) LMNAMAPTKDM4EHPGDALDH1A1
Methyl 4-Methoxybenzoate SCHEMBL231243 0.57 CA1 (1.00) LMNAMAPTKDM4ECA1CA2
SCHEMBL11502770 0.57 HSD11B1 (0.43) LMNAKDM4EALDH1A1KMT2ASMN1; SMN2

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
US-5538966-A ENZYME INHIBITORS FOR TREATMENT OF GLAUCOMA ALCON LABORATORIES, INC. (US) 1996-07-23 US disclosed