SCHEMBL8336354

SCHEMBL8336354

CNC(=S)NC(=O)C(c1ccccc1)C(CCCC(C)OC)N=S(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.36
▸ HTT P42858 3/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ ALDH1A1 P00352 4/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ POLB P06746 1/20 0.31
▸ ALPL P05186 1/20 0.31
▸ APOBEC3G Q9HC16 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ GLS O94925 4/20 0.30
▸ RECQL P46063 1/20 0.30
▸ KCNA5 P22460 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
SCHEMBL8340676 0.88 KMT2A (0.37) KMT2AHTTMEN1KDM4ETDP1
SCHEMBL8334941 0.87 KMT2A (0.39) KMT2AHTTMEN1KDM4ETDP1
SCHEMBL8333962 0.76 KDM4E (0.37) KMT2AHTTMEN1KDM4ETDP1
SCHEMBL8340568 0.76 KDM4E (0.36) KMT2AHTTMEN1KDM4ETDP1
SCHEMBL8389247 0.70 POLB (0.32) SMN1; SMN2POLB
SCHEMBL2605850 0.66 MEN1 (0.47) KMT2AHTTMEN1KDM4ETDP1
SCHEMBL8865223 0.65 — —
SCHEMBL8337813 0.65 TDP1 (0.39) KMT2AMEN1KDM4ETDP1ALDH1A1
SCHEMBL8864588 0.64 SLC6A2 (0.31) —
SCHEMBL8864247 0.64 FPR1 (0.30) —

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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