SCHEMBL8336209

SCHEMBL8336209

CNC(=S)N(C)C(=O)C(CCCN=S(=O)=O)c1ccc(OC)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GPR88 Q9GZN0 1/20 0.35
▸ MMP1 P03956 2/20 0.33
▸ MMP9 P14780 2/20 0.33
▸ MMP13 P45452 2/20 0.33
▸ ADAM17 P78536 2/20 0.33
▸ CNR2 P34972 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ KMT2A Q03164 3/20 0.32
▸ UTS2R Q9UKP6 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC7 Q8WUI4 1/20 0.32
▸ OPRM1 P35372 1/20 0.32
▸ OPRD1 P41143 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ HTT P42858 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
SCHEMBL8389782 0.89 GPR88 (0.36) GPR88CNR2ALDH1A1KMT2AUTS2R
SCHEMBL8339611 0.88 — —
SCHEMBL8335851 0.88 CNR2 (0.38) GPR88MMP1CNR2ALDH1A1TDP1
SCHEMBL8340209 0.88 ADAM17 (0.36) GPR88MMP1MMP9MMP13ADAM17
SCHEMBL8334203 0.83 GAA (0.34) GPR88CNR2ALDH1A1TDP1KMT2A
SCHEMBL8337030 0.81 MMP1 (0.35) GPR88MMP1MMP9MMP13ADAM17
SCHEMBL8338348 0.81 TDP1 (0.39) GPR88MMP1MMP9MMP13ADAM17
SCHEMBL8339477 0.78 GPR88 (0.40) GPR88MMP1MMP9MMP13ADAM17
SCHEMBL8334475 0.77 CNR1 (0.33) CNR2ALDH1A1KMT2AUTS2RMEN1
SCHEMBL8336540 0.77 CNR2 (0.40) GPR88MMP1CNR2ALDH1A1KMT2A

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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