SCHEMBL10722267

SCHEMBL10722267

CNS(=O)(=O)c1cc(OC)c(OC)c(C(=O)OC)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.49
▸ POLB P06746 2/20 0.49
▸ HSD17B10 Q99714 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.42
▸ LMNA P02545 3/20 0.42
▸ GAA P10253 3/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ HPGD P15428 3/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ ACLY P53396 1/20 0.39
▸ NLRP3 Q96P20 1/20 0.39
▸ JAK2 O60674 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ JAK3 P52333 1/20 0.38

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
SCHEMBL10564370 0.88 KDM4E (0.43) KDM4EPOLBHSD17B10ALDH1A1HPGD
SCHEMBL11005983 0.83 KDM4E (0.54) KDM4EPOLBHSD17B10USP2ALDH1A1
SCHEMBL3880159 0.80 ALDH1A1 (0.52) KDM4EHSD17B10ALDH1A1LMNAGAA
SCHEMBL4867250 0.77 PLA2G2A (0.46) KDM4EPOLBHSD17B10USP2ALDH1A1
SCHEMBL31705480 0.74 KDM4E (0.54) KDM4EPOLBHSD17B10USP2ALDH1A1
SCHEMBL7412448 0.74 ALDH1A1 (0.43) KDM4EHSD17B10ALDH1A1GAAMEN1
SCHEMBL644055 0.74 KDM4E (0.57) KDM4EPOLBHSD17B10USP2ALDH1A1
SCHEMBL23294024 0.72 KDM4E (0.56) KDM4EPOLBHSD17B10USP2ALDH1A1
SCHEMBL20589795 0.72 KDM4E (0.65) KDM4EPOLBHSD17B10USP2ALDH1A1
SCHEMBL4871213 0.72 KDM4E (0.56) KDM4EPOLBHSD17B10USP2ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4673686-A CNS MODIFIERS, ANTI-APOMORPHINE ANTIENETIC ACITIVTY/ SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLE DE L'ILE DE FRANCE (FR) 1987-06-16 — — US disclosed
US-4364867-A URINARY SYSTEM DISORDERS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE DE FRANCE (FR) 1982-12-21 — — US disclosed
US-4263316-A ANTISPASMODIC, FOR URINARY DISORDERS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE DE FRANCE (FR) 1981-04-21 — — US disclosed
US-4029673-A N-(1-benzyl pyrrolidinyl 2-alkyl) substituted benzamides and derivatives thereof SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1977-06-14 — — US disclosed
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