SCHEMBL8340568

SCHEMBL8340568

CCCCCCCC(N=S(=O)=O)C(C(=O)NC(=S)NC)c1ccc(C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MMP1 P03956 5/20 0.31
▸ MMP2 P08253 5/20 0.31
▸ MMP9 P14780 4/20 0.31
▸ MMP3 P08254 2/20 0.31
▸ MMP14 P50281 1/20 0.31
▸ ADAM17 P78536 3/20 0.31
▸ MMP13 P45452 2/20 0.31
▸ S1PR2 O95136 1/20 0.31
▸ S1PR1 P21453 1/20 0.31
▸ S1PR3 Q99500 1/20 0.31
▸ LPAR2 Q9HBW0 1/20 0.31

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
SCHEMBL8340828 1.00 KDM4E (0.36) KDM4EALDH1A1LMNAMEN1HTT
SCHEMBL8333962 0.99 KDM4E (0.37) KDM4EALDH1A1LMNAMEN1HTT
SCHEMBL8334654 0.78 MMP1 (0.46) MMP1MMP2MMP9MMP3ADAM17
SCHEMBL8334941 0.77 KMT2A (0.39) KDM4EALDH1A1LMNAMEN1HTT
SCHEMBL8340341 0.77 KDM4E (0.36) KDM4EALDH1A1LMNAMEN1HTT
SCHEMBL8339878 0.74 ALDH1A1 (0.33) KDM4EALDH1A1LMNAMEN1HTT
SCHEMBL8338863 0.73 ALDH1A1 (0.35) KDM4EALDH1A1LMNAMEN1HTT
SCHEMBL8338337 0.73 GAA (0.35) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL8339028 0.70 GAA (0.33) KDM4EALDH1A1LMNAMEN1HTT
SCHEMBL8334670 0.70 MMP9 (0.41) KDM4EHTTTDP1MMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5977177-A Substituted benzenesulfonylureas and-thioureas, processes for their preparation and use of pharmaceutical preparations based on these compounds, and medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1999-11-02 — — US disclosed
US-5880155-A TREATMENT OF CARDIOVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1999-03-09 — — US disclosed
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