SCHEMBL8335690

SCHEMBL8335690

CCCCCC1(N=S(=O)=O)CC1.CNC(=S)NC(=O)C(C)c1ccc(OC)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 2/20 0.36
▸ MMP9 P14780 2/20 0.36
▸ MMP13 P45452 2/20 0.36
▸ ADAM17 P78536 2/20 0.36
▸ GPR88 Q9GZN0 3/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ CRHBP P24387 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ GAA P10253 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ KMT2A Q03164 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ FAAH O00519 1/20 0.32

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
SCHEMBL8338656 0.84 HTT (0.37) MMP1MMP9MMP13ADAM17KDM4E
SCHEMBL8340007 0.80 TDP1 (0.49) KDM4ECRHBPHTTCRHR2ALDH1A1
SCHEMBL8340223 0.78 MMP1 (0.34) MMP1MMP9MMP13ADAM17GPR88
SCHEMBL8335999 0.76 TDP1 (0.51) KDM4ECRHBPHTTCRHR2ALDH1A1
SCHEMBL8336211 0.73 HTT (0.42) KDM4EHTTGAAALDH1A1MAPT
SCHEMBL8336596 0.72 TDP1 (0.53) KDM4ECRHBPHTTCRHR2ALDH1A1
SCHEMBL8334670 0.71 MMP9 (0.41) MMP1MMP9MMP13ADAM17KDM4E
SCHEMBL8392500 0.70 MMP9 (0.43) MMP1MMP9MMP13ADAM17KDM4E
SCHEMBL8336310 0.70 MMP9 (0.43) MMP1MMP9MMP13ADAM17KDM4E
SCHEMBL8338140 0.70 MMP9 (0.38) MMP1MMP9MMP13ADAM17KDM4E

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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