SCHEMBL8334058

SCHEMBL8334058

CCCCCC(CCC(C(=O)NC(=O)NC(C)C)c1ccc(OC)cc1)N=S(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MMP9 P14780 5/20 0.41
▸ MMP13 P45452 5/20 0.41
▸ ADAM17 P78536 4/20 0.41
▸ MMP1 P03956 4/20 0.41
▸ FAAH O00519 1/20 0.36
▸ GPR88 Q9GZN0 3/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MMP2 P08253 1/20 0.34
▸ MMP3 P08254 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC7 Q8WUI4 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ TAS1R3 Q7RTX0 2/20 0.34
▸ TAS1R1 Q7RTX1 2/20 0.34
▸ KCNQ2 O43526 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
SCHEMBL8340743 0.91 MMP9 (0.40) MMP9MMP13ADAM17MMP1FAAH
SCHEMBL8337089 0.90 MMP9 (0.43) MMP9MMP13ADAM17MMP1FAAH
SCHEMBL8336849 0.89 MMP9 (0.44) MMP9MMP13ADAM17MMP1FAAH
SCHEMBL8339304 0.89 MMP9 (0.42) MMP9MMP13ADAM17MMP1FAAH
SCHEMBL8340431 0.87 MMP9 (0.39) MMP9MMP13ADAM17MMP1FAAH
SCHEMBL8339718 0.86 MMP9 (0.40) MMP9MMP13ADAM17MMP1GPR88
SCHEMBL8334670 0.85 MMP9 (0.41) MMP9MMP13ADAM17MMP1FAAH
SCHEMBL8392500 0.84 MMP9 (0.43) MMP9MMP13ADAM17MMP1FAAH
SCHEMBL8332853 0.84 MMP9 (0.41) MMP9MMP13ADAM17MMP1FAAH
SCHEMBL8336310 0.84 MMP9 (0.43) MMP9MMP13ADAM17MMP1FAAH

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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