SCHEMBL6967712

SCHEMBL6967712

c1ccc(-c2ccc(COCC3CCc4[nH]cnc4C3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.44
ADRA1A P35348 4/20 0.40
BACE1 P56817 1/20 0.37
HRH4 Q9H3N8 5/20 0.35
HRH3 Q9Y5N1 5/20 0.35
ADRA1D P25100 1/20 0.35
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
CTSK P43235 1/20 0.34

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
SCHEMBL6954794 0.84 CHRNB2 (0.51) ADRA1AADRA1D
SCHEMBL6965650 0.84 SLC6A2 (0.40) ADRA1A
SCHEMBL6968121 0.83 IDO1 (0.35) ADRA1A
SCHEMBL6961813 0.81 ADRA1A (0.41) ADRA1AHRH4HRH3ADRA1D
SCHEMBL6962280 0.80 DRD2 (0.46) ADRA1AHRH4HRH3ADRA1D
Hydrochloric Acid SCHEMBL6963559 0.80 ADRA1A (0.40) ADRA1AHRH4HRH3ADRA1D
SCHEMBL6963392 0.79 CHRNB2 (0.41) ADRA1ABACE1ADRA1D
SCHEMBL6962222 0.79 DRD2 (0.43) NAAAADRA1AHRH3ADRA1D
SCHEMBL6964292 0.78 ADRA1A (0.41) ADRA1AADRA1D
SCHEMBL6967721 0.78 DRD2 (0.42) NAAAADRA1AHRH3ADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6610721-B2 Imidazo heterocyclic compounds NOVO NORDISK A/S (DK) 2003-08-26 US disclosed
EP-1268483-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2003-01-02 EP disclosed
US-20010049385-A1 Imidazo heterocyclic compounds HIGH POINT PHARMACEUTICALS, LLC 2001-12-06 US disclosed
WO-2001068651-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 (1 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-20010049385-A1 Imidazo heterocyclic compounds HRH4, HRH3, HRH2 NAAA 534/4885ADRA1A 212/4885BACE1 3696/4885

“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.