SCHEMBL6187686

SCHEMBL6187686

c1ccn(-c2cncc(N3CC4CNCC4C3)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.55
CHRNA4 P43681 3/20 0.55
CHRNA7 P36544 1/20 0.55
BPTF Q12830 1/20 0.49
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 1/20 0.44

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
SCHEMBL652105 0.78 CHRNB2 (0.56) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL651490 0.78 CHRNB2 (0.56) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL651641 0.78 CHRNB2 (0.56) CHRNB2CHRNA4CHRNA7BPTF
SCHEMBL6187377 0.78 CHRNB2 (0.70) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL6189169 0.78 CHRNB2 (0.56) CHRNB2CHRNA4CHRNA7BPTFCHRNB4
SCHEMBL651642 0.78 CHRNB2 (0.56) CHRNB2CHRNA4CHRNA7BPTF
SCHEMBL6190440 0.78 CHRNB2 (0.70) CHRNB2CHRNA4CHRNA7CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL649981 0.76 CHRNB2 (0.58) CHRNB2CHRNA4CHRNA7
Hydrochloric Acid SCHEMBL649982 0.76 CHRNB2 (0.58) CHRNB2CHRNA4CHRNA7
SCHEMBL6187698 0.76 CHRNB4 (0.68) CHRNB2CHRNA4CHRNA7BPTFCHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1274710-B1 NOVEL HETEROARYL-DIAZABICYCLOALKANES NEUROSEARCH AS (DK) 2005-02-23 EP claimed
EP-1274710-A2 NOVEL HETEROARYL-DIAZABICYCLOALKANES NeuroSearch A/S (DK) 2003-01-15 EP claimed
US-20030004153-A1 Novel heteroaryl-diazabicycloalkanes NEUROSEARCH A/S (DK) 2003-01-02 US claimed
WO-2001044243-A2 NOVEL HETEROARYL-DIAZABICYCLOALKANES NEUROSEARCH A/S (DK) 2001-06-21 WO claimed
EP-1274710-B1 NOVEL HETEROARYL-DIAZABICYCLOALKANES NEUROSEARCH AS (DK) 2005-02-23 EP disclosed
US-6815438-B2 CENTRAL NERVOUS SYSTEM DISORDERS NEUROSEARCH A/S (DK) 2004-11-09 US disclosed
US-20030004153-A1 Novel heteroaryl-diazabicycloalkanes NEUROSEARCH A/S (DK) 2003-01-02 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-20030004153-A1 Novel heteroaryl-diazabicycloalkanes CHRNA2, CHRNA5, CHRNA6 CHRNB2 6/4885CHRNA4 8/4885CHRNA7 4/4885

“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.