SCHEMBL10564370

SCHEMBL10564370

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ MAPK1 P28482 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ JAK2 O60674 1/20 0.41
▸ JAK1 P23458 1/20 0.41
▸ TYK2 P29597 1/20 0.41
▸ JAK3 P52333 1/20 0.41
▸ HPGD P15428 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ TPMT P51580 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ ACLY P53396 1/20 0.40
▸ ECE1 P42892 1/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ POLB P06746 1/20 0.39

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
SCHEMBL10722267 0.88 KDM4E (0.49) KDM4ENPSR1ALDH1A1JAK2JAK1
SCHEMBL3869771 0.81 CA1 (0.50) KDM4EPKMALDH1A1HPGDHSD17B10
SCHEMBL10565520 0.81 KDM4E (0.46) KDM4ENPSR1MAPK1PKMALDH1A1
SCHEMBL10563868 0.80 ALDH1A1 (0.45) KDM4EMAPK1PKMALDH1A1HPGD
SCHEMBL3878089 0.80 MAPK1 (0.62) KDM4ENPSR1MAPK1ALDH1A1TSHR
SCHEMBL11150060 0.79 GAA (0.50) KDM4EMAPK1PKMALDH1A1HPGD
SCHEMBL7164182 0.75 ALDH1A1 (0.52) KDM4EALDH1A1MAPTTSHRPOLB
SCHEMBL19187645 0.74 METAP2 (0.50) NPSR1ALDH1A1MAPTHTR2CTSHR
SCHEMBL11159013 0.72 KDM4E (0.73) KDM4ENPSR1MAPK1PKMALDH1A1
SCHEMBL10355461 0.72 ACHE (0.59) KDM4EPKMALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4816471-A NERVOUS SYSTEM DISORDERS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILLE-DE FRANCE (FR) 1989-03-28 — — US disclosed
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
EP-0068700-A1 Azobicycloalkylbenzamides, process for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1983-01-05 — — EP 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
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