SCHEMBL6846885

SCHEMBL6846885

NCCC1CCCc2[nH]cnc21

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.36
LMNA P02545 1/20 0.35
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
HRH3 Q9Y5N1 2/20 0.31
HRH2 P25021 1/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31

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
SCHEMBL6851078 0.88 RAB9A (0.37) RAB9ALMNAALDH1A1POLB
SCHEMBL6846884 0.78 RAB9A (0.33) RAB9ALMNAALDH1A1POLB
SCHEMBL7006799 0.75 AOC3 (0.37) RAB9ALMNAALDH1A1POLB
SCHEMBL16152062 0.72 RAB9A (0.40) RAB9ALMNAALDH1A1POLBHRH3
SCHEMBL6851378 0.72 RAB9A (0.40) RAB9ALMNAALDH1A1POLB
SCHEMBL6967659 0.69 KDM1A (0.38) ALDH1A1POLB
SCHEMBL6851075 0.69 SIRT1 (0.40) RAB9ALMNA
SCHEMBL6967672 0.68 L3MBTL1 (0.43) RAB9ALMNA
SCHEMBL6966926 0.68 ALDH1A1 (0.33) RAB9AALDH1A1POLBHRH3
SCHEMBL6847091 0.68 AOC3 (0.42) ALDH1A1POLB

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 RAB9A 1533/4885LMNA 4098/4885ALDH1A1 1600/4885
US-20020058659-A1 Imidazole compounds HRH3, HRH4, HRH2 RAB9A 1533/4885LMNA 4098/4885ALDH1A1 1600/4885

“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.