SCHEMBL6963392

SCHEMBL6963392

c1ccc(-c2cccc(OCC3CCc4[nH]cnc4C3)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.41
CHRNA4 P43681 1/20 0.41
ADRA1A P35348 5/20 0.41
NR1H4 Q96RI1 1/20 0.40
CHRNB1 P11230 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNB3 Q05901 1/20 0.38
FABP1 P07148 1/20 0.38
FFAR1 O14842 1/20 0.37
LRRK2 Q5S007 1/20 0.37
EP300 Q09472 1/20 0.37
LTA4H P09960 1/20 0.36
FFAR4 Q5NUL3 2/20 0.36
BACE1 P56817 1/20 0.36
SOD1 P00441 1/20 0.36
ADRA1D P25100 1/20 0.35

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
SCHEMBL6957018 0.83 SLC6A2 (0.53) ADRA1A
SCHEMBL6962031 0.83 SLC6A2 (0.42) ADRA1ALRRK2
SCHEMBL6960596 0.82 SGPL1 (0.43) ADRA1A
SCHEMBL6962600 0.82 KMT2A (0.44) CHRNB2CHRNA4ADRA1AFFAR1
SCHEMBL6963118 0.80 LTA4H (0.46) ADRA1ALTA4H
SCHEMBL6956969 0.78 CYP2D6 (0.43) BACE1
SCHEMBL6966088 0.77 ADRA1A (0.39) ADRA1A
SCHEMBL6960436 0.77 LMNA (0.40) ADRA1ALTA4H
Hydrochloric Acid SCHEMBL6968688 0.76 ADRA1A (0.39) ADRA1ALTA4H
SCHEMBL6954794 0.75 CHRNB2 (0.51) CHRNB2CHRNA4ADRA1ACHRNB4CHRNA3

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 CHRNB2 436/4885CHRNA4 130/4885ADRA1A 212/4885

“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.