SCHEMBL11264951

SCHEMBL11264951

CCC(NC(=O)c1c(NC(C)=O)c(NC(C)=O)cc2c1OCCO2)N1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 6/20 0.39
KDM4E B2RXH2 5/20 0.39
ALDH1A1 P00352 4/20 0.39
ALOX15 P16050 4/20 0.39
KMT2A Q03164 3/20 0.38
POLB P06746 2/20 0.38
MEN1 O00255 2/20 0.38
CASP1 P29466 2/20 0.34
USP2 O75604 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 2/20 0.33
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
TP53 P04637 1/20 0.32
CASP7 P55210 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
SCHEMBL11400930 0.77 HPGD (0.47) HSD17B10KDM4EALDH1A1ALOX15KMT2A
SCHEMBL11273592 0.74 KDM4E (0.52) HSD17B10KDM4EALDH1A1ALOX15KMT2A
SCHEMBL25082649 0.62 KDM4E (0.56) HSD17B10KDM4EALDH1A1ALOX15KMT2A
SCHEMBL30884780 0.62 KDM4E (0.56) HSD17B10KDM4EALDH1A1ALOX15KMT2A
Hydrochloric Acid SCHEMBL7361677 0.61 HTR4 (0.52)
SCHEMBL11397113 0.60 CHRNA7 (0.36) ALDH1A1KMT2AMEN1
SCHEMBL30884745 0.60 KDM4E (0.47) HSD17B10KDM4EALDH1A1ALOX15KMT2A
SCHEMBL25082650 0.60 KDM4E (0.47) HSD17B10KDM4EALDH1A1ALOX15KMT2A
Hydrochloric Acid SCHEMBL11263850 0.60 CHRNA7 (0.35) ALDH1A1KMT2AMEN1
SCHEMBL17220673 0.60 CHRNA1 (0.60) ALDH1A1KMT2AMEN1MAPTSMN1; SMN2

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-4255580-A TREATMENT OF PSYCHOLOGICAL DISORDERS SIOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1981-03-10 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