SCHEMBL11597826

SCHEMBL11597826

CC(C)(C)NS(=O)(=O)c1cc(C(=O)CCl)ccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.51
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ THRB P10828 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ GSTO1 P78417 3/20 0.46
▸ HSD17B10 Q99714 1/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ GSK3B P49841 1/20 0.41

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
SCHEMBL10962880 0.85 GSTO1 (0.62) POLBSMN1; SMN2KDM4EKMT2AGSTO1
SCHEMBL11595561 0.84 POLB (0.62) POLBSMN1; SMN2KDM4EKMT2AMEN1
SCHEMBL11595632 0.84 POLB (0.54) POLBSMN1; SMN2KDM4EKMT2AMEN1
SCHEMBL11632306 0.83 GSTO1 (0.46) POLBSMN1; SMN2KDM4EKMT2AMEN1
SCHEMBL11595388 0.82 GSTO1 (0.50) POLBSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL11780405 0.79 GSK3B (0.48) SMN1; SMN2KMT2AALDH1A1TDP1CYP1A2
SCHEMBL11596906 0.78 LMNA (0.55) POLBKMT2AALDH1A1LMNAL3MBTL1
SCHEMBL11531237 0.77 CA1 (0.62) CA1CA2
SCHEMBL11183264 0.77 GSTO1 (0.60) POLBSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL13545186 0.77 GSTO1 (0.55) POLBSMN1; SMN2KDM4EKMT2AGSTO1

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-4125614-A DIURETIC HOECHST AKTIENGESELLSCHAFT (DE) 1978-11-14 — — US disclosed
US-4061761-A Thiazolidine derivatives HOECHST AKTIENGESELLSCHAFT (DT) 1977-12-06 — — US disclosed
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