SCHEMBL8339172

SCHEMBL8339172

CCCCC(CC)N(C(=O)NC)C(=O)C(C)c1ccc(OC)c(N=S(=O)=O)c1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HIF1A Q16665 1/20 0.32
▸ TAS1R3 Q7RTX0 1/20 0.32
▸ TAS1R1 Q7RTX1 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ SMPD1 P17405 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ PDE4D Q08499 1/20 0.31
▸ QPCT Q16769 1/20 0.30

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
SCHEMBL8334657 0.94 SMN1; SMN2 (0.34) SMN1; SMN2HIF1ATAS1R3TAS1R1
SCHEMBL8334942 0.93 SMN1; SMN2 (0.36) SMN1; SMN2HIF1ATAS1R3TAS1R1ALDH1A1
SCHEMBL8338131 0.92 HIF1A (0.35) SMN1; SMN2HIF1A
SCHEMBL8340001 0.91 SMN1; SMN2 (0.36) SMN1; SMN2HIF1ATAS1R3TAS1R1ALDH1A1
SCHEMBL8335692 0.90 SMN1; SMN2 (0.35) SMN1; SMN2HIF1AALDH1A1GLAMAPT
SCHEMBL8337752 0.88 SMN1; SMN2 (0.35) SMN1; SMN2HIF1ASMPD1
SCHEMBL8336318 0.87 SMPD1 (0.35) SMN1; SMN2SMPD1
SCHEMBL8340685 0.87 SMN1; SMN2 (0.33) SMN1; SMN2HIF1ATAS1R3TAS1R1ALDH1A1
SCHEMBL8336029 0.87 TAS1R3 (0.33) SMN1; SMN2HIF1ATAS1R3TAS1R1GLA
SCHEMBL8339968 0.86 HIF1A (0.35) SMN1; SMN2HIF1A

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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