SCHEMBL8337030

SCHEMBL8337030

CCN(C(=O)NC)C(=O)C(CCCN=S(=O)=O)c1ccc(OC)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 2/20 0.35
▸ MMP9 P14780 2/20 0.35
▸ MMP13 P45452 2/20 0.35
▸ ADAM17 P78536 2/20 0.35
▸ GPR88 Q9GZN0 1/20 0.35
▸ FAAH O00519 1/20 0.34
▸ HPGD P15428 1/20 0.33
▸ TSPO P30536 1/20 0.33
▸ CNR2 P34972 3/20 0.33
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC7 Q8WUI4 1/20 0.32
▸ OPRM1 P35372 1/20 0.32
▸ OPRD1 P41143 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ TAS1R3 Q7RTX0 1/20 0.32
▸ TAS1R1 Q7RTX1 1/20 0.32
▸ C3AR1 Q16581 1/20 0.32
▸ PLK1 P53350 1/20 0.32
▸ CNR1 P21554 1/20 0.31
▸ ALOX5 P09917 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
SCHEMBL8340209 0.90 ADAM17 (0.36) MMP1MMP9MMP13ADAM17GPR88
SCHEMBL8338167 0.88 HPGD (0.39) MMP1MMP9MMP13ADAM17GPR88
SCHEMBL8389782 0.87 GPR88 (0.36) GPR88FAAHCNR2HDAC1HDAC7
SCHEMBL8336209 0.81 GPR88 (0.35) MMP1MMP9MMP13ADAM17GPR88
SCHEMBL8339477 0.78 GPR88 (0.40) MMP1MMP9MMP13ADAM17GPR88
SCHEMBL8333490 0.78 — —
SCHEMBL8334765 0.78 HPGD (0.37) MMP1MMP9MMP13ADAM17GPR88
SCHEMBL8338348 0.77 TDP1 (0.39) MMP1MMP9MMP13ADAM17GPR88
SCHEMBL8336540 0.74 CNR2 (0.40) MMP1GPR88CNR2OPRM1OPRD1
SCHEMBL8334276 0.70 ALOX5 (0.34) GPR88CNR2OPRM1OPRD1ALOX5

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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