SCHEMBL6352285

SCHEMBL6352285

CCOCCOCCOc1cncc(N2CCN(C)CC2)c1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 6/20 0.50
CHRNA4 P43681 6/20 0.50
CHRNB4 P30926 2/20 0.43
CHRNA3 P32297 2/20 0.43
HTR3A P46098 1/20 0.41

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
SCHEMBL6351694 0.95 CHRNB2 (0.52) CHRNB2CHRNA4
SCHEMBL5658769 0.86 CHRNB2 (0.51) CHRNB2CHRNA4HTR3A
SCHEMBL3453656 0.86 CHRNB2 (0.57) CHRNB2CHRNA4CHRNB4CHRNA3HTR3A
SCHEMBL6350260 0.86 CHRNB2 (0.68) CHRNB2CHRNA4
SCHEMBL3453596 0.85 CHRNB2 (0.50) CHRNB2CHRNA4
SCHEMBL5657195 0.84 CHRNB2 (0.49) CHRNB2CHRNA4
SCHEMBL6351563 0.82 CHRNB2 (0.77) CHRNB2CHRNA4
SCHEMBL6352741 0.82 CHRNB2 (0.53) CHRNB2CHRNA4
SCHEMBL6352066 0.81 CHRNB2 (0.49) CHRNB2CHRNA4
SCHEMBL6351352 0.81 CHRNB2 (0.52) CHRNB2CHRNA4CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6897219-B2 Heteroaryl diazacycloalkanes, their preparation and use NEUROSEARCH A/S (DK) 2005-05-24 US disclosed
US-6825189-B1 TREATING WITHDRAWAL SYMPTOMS CAUSED BY SMOKING CESSATION NEUROSEARCH A/S (DK) 2004-11-30 US disclosed
US-20040072823-A1 Heteroaryl diazacycloalkanes, their preparation and use; NEUROSEARCH A/S 2004-04-15 US 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-20040072823-A1 Heteroaryl diazacycloalkanes, their preparation and use; OGFR, CBR3, OGFRL1 CHRNB2 700/4885CHRNA4 1019/4885CHRNB4 1055/4885

“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.