SCHEMBL6846945

SCHEMBL6846945

Cc1cccc(OCCCCN)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.57
DRD4 P21917 2/20 0.57
DRD3 P35462 1/20 0.55
NOS3 P29474 1/20 0.55
NOS1 P29475 1/20 0.55
NOS2 P35228 1/20 0.55
KDM4E B2RXH2 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
HSD17B10 Q99714 2/20 0.54
LMNA P02545 1/20 0.54
HTT P42858 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
TSHR P16473 1/20 0.51
CYP2C19 P33261 1/20 0.51
TDP1 Q9NUW8 2/20 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
SCHEMBL15922828 0.98 DRD2 (0.55) DRD2DRD4DRD3NOS3NOS1
SCHEMBL10085645 0.94 DRD2 (0.58) DRD2DRD4DRD3NOS3NOS1
SCHEMBL11674802 0.90 DRD2 (0.66) DRD2DRD4DRD3KDM4EL3MBTL1
Dimethylamine SCHEMBL10861113 0.89 DRD2 (0.58) DRD2DRD4DRD3NOS3NOS1
SCHEMBL30230126 0.89 TAAR1 (0.57) DRD2DRD4DRD3KDM4EL3MBTL1
SCHEMBL7408051 0.89 TAAR1 (0.57) DRD2DRD4DRD3KDM4EL3MBTL1
SCHEMBL10798638 0.88 DRD2 (0.64) DRD2DRD4DRD3KDM4EL3MBTL1
SCHEMBL9926200 0.88 DRD2 (0.53) DRD2DRD4DRD3NOS3NOS1
SCHEMBL29381067 0.84 DRD2 (0.62) DRD2DRD4DRD3KDM4EL3MBTL1
SCHEMBL27465 0.84 DRD2 (0.62) DRD2DRD4DRD3KDM4EL3MBTL1

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 DRD2 668/4885DRD4 1390/4885DRD3 572/4885
US-20020058659-A1 Imidazole compounds HRH3, HRH4, HRH2 DRD2 668/4885DRD4 1390/4885DRD3 572/4885

“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.