SCHEMBL11269820

SCHEMBL11269820

CCN(CC)S(=O)(=O)c1cc2c(c(C(=O)NCc3ccccc3)c1)OCCO2

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
MAPK1 P28482 1/20 0.54
ALDH1A1 P00352 9/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
LMNA P02545 5/20 0.48
MAPT P10636 2/20 0.48
GAA P10253 1/20 0.48
RAB9A P51151 2/20 0.47
HSD17B10 Q99714 2/20 0.47
HPGD P15428 1/20 0.47
CA12 O43570 1/20 0.47
CA9 Q16790 1/20 0.47
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.45
F2 P00734 1/20 0.43
ALOX15 P16050 1/20 0.43

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
SCHEMBL11266948 0.81 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2LMNAMAPTGAA
SCHEMBL11363999 0.81 DRD2 (0.51)
Phosphoric Acid SCHEMBL11257050 0.79 DRD2 (0.49)
SCHEMBL11364002 0.79 ALDH1A1 (0.38) POLBMAPK1ALDH1A1SMN1; SMN2LMNA
Phosphoric Acid SCHEMBL11257055 0.77 ALDH1A1 (0.37) POLBMAPK1ALDH1A1SMN1; SMN2LMNA
SCHEMBL27311891 0.69 ALDH1A1 (0.62) POLBMAPK1ALDH1A1SMN1; SMN2LMNA
SCHEMBL11259209 0.68 MEN1 (0.47) POLBALDH1A1SMN1; SMN2GAARAB9A
SCHEMBL10260134 0.67 SMN1; SMN2 (0.85) POLBMAPK1ALDH1A1SMN1; SMN2LMNA
SCHEMBL11270751 0.66 ALDH1A1 (0.40) POLBMAPK1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL14484970 0.66 POLB (0.67) POLBMAPK1ALDH1A1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 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