SCHEMBL8336148

SCHEMBL8336148

CNC(=O)N(C(=O)C(CN=S(=O)=O)c1ccc(OC)cc1)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ EPHX2 P34913 2/20 0.36
▸ P2RX7 Q99572 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ LMNA P02545 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ MMP2 P08253 1/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ HSD11B1 P28845 1/20 0.34
▸ P2RX2 Q9UBL9 1/20 0.34

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
SCHEMBL8340993 0.80 EPHX2 (0.36) KMT2AMEN1CNR2EPHX2ALDH1A1
SCHEMBL8336540 0.79 CNR2 (0.40) KMT2ACNR2ALDH1A1
SCHEMBL8338167 0.77 HPGD (0.39) CNR2LMNAMMP9
SCHEMBL8335851 0.73 CNR2 (0.38) KMT2AMEN1CNR2ALDH1A1NPSR1
SCHEMBL8334765 0.71 HPGD (0.37) KMT2AMEN1CNR2ALDH1A1NPSR1
SCHEMBL8334832 0.71 CNR2 (0.37) KMT2AMEN1CNR2ALDH1A1NPSR1
SCHEMBL8339597 0.71 KMT2A (0.37) KMT2AMEN1EPHX2
SCHEMBL8392591 0.69 ALDH1A1 (0.39) KMT2AMEN1CNR2P2RX7SIGMAR1
SCHEMBL8389782 0.68 GPR88 (0.36) KMT2AMEN1CNR2ALDH1A1
SCHEMBL8391019 0.68 EPHX2 (0.51) KMT2AEPHX2ALDH1A1

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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