SCHEMBL5849713

SCHEMBL5849713

O=C1NCC(c2ccc(Cl)cc2)=C1c1ccc(S(=O)(=O)NC2CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.46
▸ HTT P42858 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ KMT2A Q03164 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ PTGS2 P35354 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ HTR1A P08908 1/20 0.39
▸ HTR7 P34969 1/20 0.39
▸ MMP2 P08253 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ PSEN1 P49768 2/20 0.39
▸ PSEN2 P49810 2/20 0.39
▸ APH1B Q8WW43 2/20 0.39
▸ NCSTN Q92542 2/20 0.39
▸ APH1A Q96BI3 2/20 0.39
▸ PSENEN Q9NZ42 2/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39

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
SCHEMBL5849863 0.88 ALDH1A1 (0.53) PKMHTTKDM4ERECQLSMN1; SMN2
SCHEMBL5848641 0.88 MAP2K4 (0.48) PKMKDM4ERECQLSMN1; SMN2KMT2A
SCHEMBL5848834 0.88 PKM (0.42) PKMHTTKDM4ERECQLSMN1; SMN2
SCHEMBL5849888 0.82 MMP1 (0.41) PKMKDM4ERECQLSMN1; SMN2KMT2A
SCHEMBL5848008 0.81 LMNA (0.44) PKMKDM4ERECQLSMN1; SMN2HTR1A
SCHEMBL5848446 0.81 MAPK1 (0.42) PKMHTTKDM4ERECQLSMN1; SMN2
SCHEMBL5848434 0.79 PTGS2 (0.46) KDM4ESMN1; SMN2KMT2APTGS2
SCHEMBL2178427 0.78 KDM4E (0.68) HTTKDM4ERECQLSMN1; SMN2KMT2A
SCHEMBL11089094 0.74 GSK3B (0.45) KDM4EKMT2APTGS2
SCHEMBL14842266 0.72 SMN1; SMN2 (0.75) HTTKDM4ERECQLSMN1; SMN2KMT2A

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-7112605-B2 Sulfonyl-containing 3,4-diaryl-3-pyrrolin-2-ones, preparation method, and medical use thereof Research Institute of Materia Medica Chinese Acadamy of Medical Sciences (CN) 2006-09-26 — — US claimed
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