SCHEMBL6017214

SCHEMBL6017214

O=S(=O)(c1cccc2nsnc12)N1CN(C2CCNCC2)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.56
▸ ALDH1A1 P00352 5/20 0.55
▸ SMN1; SMN2 Q16637 5/20 0.55
▸ MAPK1 P28482 4/20 0.55
▸ GAA P10253 4/20 0.55
▸ PKM P14618 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ NPC1 O15118 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ TSHR P16473 1/20 0.50
▸ HTR6 P50406 1/20 0.49
▸ LMNA P02545 2/20 0.49
▸ KDM2B Q8NHM5 1/20 0.49
▸ CYP2C19 P33261 4/20 0.47
▸ CYP1A2 P05177 3/20 0.47
▸ CYP2C9 P11712 3/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ MAPT P10636 4/20 0.47
▸ POLB P06746 1/20 0.46
▸ USP2 O75604 2/20 0.46

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
SCHEMBL4431335 0.74 KMT2A (0.57) KMT2AALDH1A1SMN1; SMN2MAPK1GAA
SCHEMBL10016542 0.72 SMN1; SMN2 (1.00) KMT2AALDH1A1SMN1; SMN2MAPK1GAA
SCHEMBL6016995 0.68 HTT (0.46) KMT2AALDH1A1SMN1; SMN2MAPK1GAA
SCHEMBL6017067 0.67 HTR2C (0.33) HTR6
SCHEMBL6017056 0.67 HTR2C (0.36) PKMKDM4EHTR6LMNAMAPT
SCHEMBL17918250 0.66 KDM2B (1.00) KDM2B
SCHEMBL2954365 0.65 SMN1; SMN2 (0.80) KMT2AALDH1A1SMN1; SMN2MAPK1GAA
SCHEMBL3154636 0.65 HTR6 (0.70) KMT2AALDH1A1SMN1; SMN2MAPK1GAA
SCHEMBL4490191 0.64 HTR6 (0.76) KMT2AALDH1A1SMN1; SMN2MAPK1GAA
SCHEMBL6985771 0.63 KMT2A (0.79) KMT2AALDH1A1SMN1; SMN2MAPK1GAA

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
EP-1654258-A1 SULFONYLDIHYDRO- BENZIMIDAZOLONE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth (US) 2006-05-10 — — EP claimed
WO-2005009996-A1 SULFONYLDIHYDRO- BENZIMIDAZOLONE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2005-02-03 — — WO claimed
EP-1654258-A1 SULFONYLDIHYDRO- BENZIMIDAZOLONE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth (US) 2006-05-10 — — EP disclosed
WO-2005009996-A1 SULFONYLDIHYDRO- BENZIMIDAZOLONE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2005-02-03 — — WO disclosed
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