SCHEMBL9634028

SCHEMBL9634028

NC(=S)N(c1ccccc1)S(=O)(=O)c1ccccn1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
PKM P14618 3/20 0.36
KDM4E B2RXH2 2/20 0.36
PTGER2 P43116 1/20 0.36
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
KMT2A Q03164 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
LOX P28300 1/20 0.35
C1S P09871 1/20 0.34
OXTR P30559 1/20 0.34
POLB P06746 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL9455586 0.76 PKM (0.39) ALDH1A1PKMKDM4EPTGER2NFE2L2
SCHEMBL27469362 0.73 ALDH1A1 (0.52) ALDH1A1KMT2AL3MBTL1
SCHEMBL4759310 0.72 CA12 (0.50) ALDH1A1PKMKDM4EKMT2A
SCHEMBL27469364 0.72 ALDH1A1 (0.50) ALDH1A1PKMKMT2AL3MBTL1
SCHEMBL9750530 0.71 PKM (0.40) ALDH1A1PKMKDM4EPTGER2NFE2L2
SCHEMBL28634012 0.69 KDM4E (0.41) ALDH1A1PKMKDM4ENFE2L2KMT2A
SCHEMBL2810981 0.69 ALDH1A1 (0.47) ALDH1A1KDM4EKMT2AL3MBTL1POLB
SCHEMBL5901579 0.68 POLB (0.50) ALDH1A1PKMKDM4EKEAP1NFE2L2
SCHEMBL9370312 0.68 L3MBTL1 (0.49) PKMKDM4EL3MBTL1MAOAMAOB
SCHEMBL30498943 0.68 TSHR (0.50) ALDH1A1PKMKDM4ENFE2L2KMT2A

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-0298915-B1 PYRIDYLTHIO-, PYRIDYLSULFINYL- AND PYRIDYLSULFONYL-PHENYL-THIOUREAS, ISOTHIOUREAS AND CARBON DIIMIDES, THEIR PREPARATION AND THEIR USE AS PESTICIDES CIBA-GEIGY AG (CH) 1992-05-20 EP disclosed
EP-0298915-A1 Pyridylthio-, pyridylsulfinyl- and pyridylsulfonyl-phenyl-thioureas, isothioureas and carbon diimides, their preparation and their use as pesticides CIBA-GEIGY AG (CH) 1989-01-11 EP disclosed
EP-0298915-A1 Pyridylthio-, pyridylsulfinyl- and pyridylsulfonyl-phenyl-thioureas, isothioureas and carbon diimides, their preparation and their use as pesticides CIBA-GEIGY AG (CH) 1989-01-11 EP disclosed