SCHEMBL28351946

SCHEMBL28351946

CCOC(=O)c1ccc(S(=O)(=O)NC2CCCCC2)cc1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.70
▸ NR3C1 P04150 1/20 0.68
▸ AR P10275 1/20 0.68
▸ KMT2A Q03164 2/20 0.67
▸ MEN1 O00255 1/20 0.67
▸ ALDH1A1 P00352 4/20 0.64
▸ GAA P10253 3/20 0.64
▸ CYP3A4 P08684 1/20 0.61
▸ TSHR P16473 1/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ KDM4E B2RXH2 1/20 0.58
▸ RECQL P46063 1/20 0.58
▸ POLB P06746 1/20 0.57
▸ GLA P06280 1/20 0.57
▸ MAPT P10636 2/20 0.56

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
SCHEMBL19230174 0.85 ALDH1A1 (0.70) LMNANR3C1ARKMT2AMEN1
SCHEMBL21292712 0.82 MEN1 (0.67) LMNAKMT2AMEN1ALDH1A1GAA
SCHEMBL12188930 0.79 SMN1; SMN2 (0.71) LMNAKMT2AMEN1ALDH1A1GAA
SCHEMBL16197620 0.79 KMT2A (0.75) LMNAKMT2AMEN1ALDH1A1GAA
SCHEMBL16197384 0.78 LMNA (0.74) LMNANR3C1ARKMT2AMEN1
SCHEMBL771186 0.78 MAPT (0.66) KMT2AMEN1ALDH1A1TSHRSMN1; SMN2
SCHEMBL28020621 0.77 KMT2A (0.73) LMNAKMT2AMEN1ALDH1A1GAA
SCHEMBL21309892 0.77 KMT2A (0.60) LMNAKMT2AMEN1ALDH1A1GAA
SCHEMBL12614743 0.77 KMT2A (0.72) LMNAKMT2AMEN1ALDH1A1GAA
SCHEMBL12189228 0.77 SMN1; SMN2 (0.73) LMNAKMT2AMEN1ALDH1A1GAA

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
CN-110759889-B 2-aryl amido substituted thiophene imide ester compound and preparation method and application thereof 中国医学科学院药物研究所 2022-05-20 — — CN disclosed
CN-110759889-A 2-aryl amido substituted thiophene imide ester compound and preparation method and application thereof 中国医学科学院药物研究所 2020-02-07 — — CN disclosed
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