SCHEMBL8340993

SCHEMBL8340993

CNC(=O)N(C(=O)C(CN=S(=O)=O)c1ccc(OC)cc1)C1C2CC3CC(C2)CC1C3

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 2/20 0.36
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ HSD11B1 P28845 2/20 0.34
▸ KMT2A Q03164 4/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ CNR2 P34972 2/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ LMNA P02545 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ GPR88 Q9GZN0 2/20 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
SCHEMBL8341066 0.80 — —
SCHEMBL8336148 0.80 KMT2A (0.38) EPHX2MMP2MMP9HSD11B1KMT2A
SCHEMBL8336540 0.79 CNR2 (0.40) KMT2ACNR2ALDH1A1GPR88
SCHEMBL8338167 0.77 HPGD (0.39) MMP9CNR2LMNAGPR88
SCHEMBL8339597 0.74 KMT2A (0.37) EPHX2KMT2AMEN1
SCHEMBL8335851 0.73 CNR2 (0.38) KMT2AMEN1CNR2CYP2C19ALDH1A1
SCHEMBL8334832 0.71 CNR2 (0.37) CA1CA2KMT2AMEN1CNR2
SCHEMBL8334765 0.71 HPGD (0.37) MMP9KMT2AMEN1CNR2ALDH1A1
SCHEMBL8389782 0.68 GPR88 (0.36) KMT2AMEN1CNR2CYP2D6ALDH1A1
SCHEMBL8391019 0.68 EPHX2 (0.51) EPHX2KMT2ACYP2D6CYP2C19ALDH1A1

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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