SCHEMBL11269520

SCHEMBL11269520

CCC(NC(=O)c1cc(S(=O)(=O)NC)cc2c1OCCO2)c1ccc[nH]1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HPGD P15428 2/20 0.36
KCNA5 P22460 8/20 0.36
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
KCNK3 O14649 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL11270721 0.96 KCNA5 (0.35) KDM4EHSD17B10SMN1; SMN2HPGDKCNA5
SCHEMBL11265109 0.91 KDM4E (0.36) KDM4EHSD17B10SMN1; SMN2HPGDKCNA5
SCHEMBL11265096 0.90 KCNK3 (0.39) KDM4EHSD17B10SMN1; SMN2HPGDKCNA5
Hydrochloric Acid SCHEMBL11259201 0.90 KDM4E (0.35) KDM4EHSD17B10SMN1; SMN2HPGDKCNA5
SCHEMBL11271371 0.89 KDM4E (0.33) KDM4EHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL11261736 0.88 KCNK3 (0.38) KDM4EHSD17B10SMN1; SMN2HPGDKCNA5
SCHEMBL11273190 0.88 GAA (0.36) KDM4EHSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL11366385 0.87 KCNA5 (0.34) KDM4EHSD17B10SMN1; SMN2HPGDKCNA5
Hydrochloric Acid SCHEMBL11258194 0.86 KCNA5 (0.34) KDM4EHSD17B10SMN1; SMN2HPGDKCNA5
SCHEMBL11356296 0.81 HTR4 (0.45) KDM4EHSD17B10HPGDTSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4248885-A FOR GASTROINTESTINAL, UROGENITAL, RHEUMATIC, AND CARDIOVASCULAR DISEASE SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1981-02-03 US claimed
US-4186135-A TREATMENT OF PSYCHOLOGICAL DISORDERS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1980-01-29 US claimed
US-4323503-A PSYCHOFUNCTION PROPERTIES SUCH AS ANXIOLYTIC OR PSYCHOSTIMULANT SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1982-04-06 US disclosed
US-4306072-A ANXIOLYTIC AND PSYCHOSTIMULANT ACTIVITY FOR TREATMENT OF PSYCHOLOGICAL DISORDERS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE (FR) 1981-12-15 US disclosed
US-4268512-A ANXIOLYTIC AGENTS, PSYCHOSTIMULANTS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1981-05-19 US disclosed
US-4255580-A TREATMENT OF PSYCHOLOGICAL DISORDERS SIOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1981-03-10 US disclosed
US-4248885-A FOR GASTROINTESTINAL, UROGENITAL, RHEUMATIC, AND CARDIOVASCULAR DISEASE SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1981-02-03 US disclosed
US-4186135-A TREATMENT OF PSYCHOLOGICAL DISORDERS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1980-01-29 US disclosed