SCHEMBL6849540

SCHEMBL6849540

NC(=O)CCCCOc1cccc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 7/20 0.63
KCNA3 P22001 1/20 0.61
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 2/20 0.57
HPGD P15428 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
SLC6A4 P31645 2/20 0.56
CNR2 P34972 3/20 0.56
OGG1 O15527 1/20 0.55
HRH1 P35367 1/20 0.54
HTR1D P28221 2/20 0.51
CNR1 P21554 1/20 0.51
MCL1 Q07820 1/20 0.50

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
SCHEMBL7279604 0.95 HTR1B (0.65) HTR1BKCNA3KDM4EALDH1A1HPGD
SCHEMBL2925774 0.92 HTR1B (0.62) HTR1BKCNA3KDM4EALDH1A1HPGD
SCHEMBL29865967 0.87 CNR2 (0.71) HTR1BKCNA3KDM4EALDH1A1HPGD
SCHEMBL20911356 0.87 CNR2 (0.71) HTR1BKCNA3KDM4EALDH1A1HPGD
SCHEMBL29865545 0.86 CNR2 (0.69) HTR1BKCNA3KDM4EALDH1A1HPGD
SCHEMBL4294120 0.86 CNR2 (0.69) HTR1BKCNA3KDM4EALDH1A1HPGD
SCHEMBL8357769 0.86 CNR2 (0.69) HTR1BKCNA3KDM4EALDH1A1HPGD
SCHEMBL29865585 0.86 CNR2 (0.69) HTR1BKCNA3KDM4EALDH1A1HPGD
SCHEMBL20886144 0.86 CNR2 (0.69) HTR1BKCNA3KDM4EALDH1A1HPGD
SCHEMBL8780102 0.86 CNR2 (0.69) HTR1BKCNA3KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6756384-B2 TREATMENT OF DISEASES AND DISORDERS RELATED TO THE HISTAMINE H3 RECEPTOR. NOVO NORDISK A/S (DK) 2004-06-29 US disclosed
US-20030135056-A1 Imidazole compounds HIGH POINT PHARMACEUTICALS, LLC 2003-07-17 US disclosed
EP-1268484-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2003-01-02 EP disclosed
US-6437147-B1 FOR THERAPY OF DISEASES OF CENTRAL NERVOUS SYSTEM, PERIPHERAL NERVOUS SYSTEM, CARDIOVASCULAR SYSTEM, PULMONARY SYSTEM, GASTROINTESTINAL SYSTEM AND ENDOCRINOLOGICAL SYSTEM NOVO NORDISK (DK) 2002-08-20 US disclosed
US-20020058659-A1 Imidazole compounds HIGH POINT PHARMACEUTICALS, LLC 2002-05-16 US disclosed
WO-2001068652-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2001-09-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030135056-A1 Imidazole compounds HRH3, HRH4, HRH2 HTR1B 114/4885KCNA3 863/4885KDM4E 2142/4885
US-20020058659-A1 Imidazole compounds HRH3, HRH4, HRH2 HTR1B 114/4885KCNA3 863/4885KDM4E 2142/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.