SCHEMBL8339955

SCHEMBL8339955

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

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.39
▸ MMP9 P14780 5/20 0.34
▸ MMP13 P45452 5/20 0.34
▸ LMNA P02545 2/20 0.34
▸ MMP8 P22894 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ PLK1 P53350 1/20 0.34
▸ ACACB O00763 3/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ADAM17 P78536 5/20 0.33
▸ MMP1 P03956 4/20 0.33
▸ GPR88 Q9GZN0 2/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ TAS1R3 Q7RTX0 1/20 0.33
▸ TAS1R1 Q7RTX1 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
SCHEMBL8334670 0.91 MMP9 (0.41) POLBMMP9MMP13ADAM17MMP1
SCHEMBL8336310 0.91 MMP9 (0.43) POLBMMP9MMP13ADAM17MMP1
SCHEMBL8392500 0.91 MMP9 (0.43) POLBMMP9MMP13ADAM17MMP1
SCHEMBL8340160 0.90 MAPT (0.37) POLBLMNAALDH1A1MAPTALOX12
SCHEMBL8334100 0.90 POLB (0.41) POLBMMP9MMP13LMNAMMP8
SCHEMBL8338140 0.89 MMP9 (0.38) POLBMMP9MMP13ALDH1A1MAPT
SCHEMBL8335548 0.88 KDM4E (0.35) POLBLMNAALDH1A1SMN1; SMN2
SCHEMBL8340341 0.85 KDM4E (0.36) LMNAALDH1A1SMN1; SMN2
SCHEMBL8338207 0.84 TDP1 (0.37) MMP9MMP13LMNAALDH1A1MAPT
SCHEMBL8332853 0.83 MMP9 (0.41) MMP9MMP13ADAM17MMP1CNR2

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-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
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