SCHEMBL4962971

SCHEMBL4962971

CC(Oc1cncc(Cl)c1)C1CCCN1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 7/20 0.49
CHRNA4 P43681 7/20 0.49
SLC6A2 P23975 5/20 0.40
SLC6A4 P31645 5/20 0.40
SLC6A3 Q01959 5/20 0.40
CHRNB4 P30926 3/20 0.37
CHRNA3 P32297 3/20 0.37
CHRNA2 Q15822 1/20 0.37

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
SCHEMBL14131571 0.93 CHRNB2 (0.46) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA2
SCHEMBL4961430 0.93 CHRNB2 (0.46) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA2
SCHEMBL4961425 0.93 CHRNB2 (0.46) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA2
SCHEMBL3221184 0.87 CHRNB2 (0.47) CHRNB2CHRNA4SLC6A2SLC6A4SLC6A3
SCHEMBL8507152 0.85 SLC6A2 (0.46) CHRNB2CHRNA4SLC6A2SLC6A4SLC6A3
SCHEMBL7411409 0.84 CHRNB4 (0.36) CHRNB2CHRNA4SLC6A2SLC6A4SLC6A3
SCHEMBL7668971 0.84 CHRNB2 (0.40) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL6233084 0.84 CHRNB2 (0.40) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL7406929 0.84 CHRNB4 (0.36) CHRNB2CHRNA4SLC6A2SLC6A4SLC6A3
SCHEMBL8550383 0.82 GPR119 (0.37) 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-20080176826-A1 Pyridine Compounds For Combating Arthropod Pests and Nematodes BASF AKTIENGESELLSCHAFT (DE) 2008-07-24 US disclosed
EP-1891045-A2 PYRIDINE COMPOUNDS FOR COMBATING ARTHROPOD PESTS AND NEMATODES BASF AKTIENGESELLSCHAFT (DE) 2008-02-27 EP disclosed
WO-2006125641-A2 PYRIDINE COMPOUNDS FOR COMBATING ARTHROPOD PESTS AND NEMATODES BASF AKTIENGESELLSCHAFT (DE) 2006-11-30 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-20080176826-A1 Pyridine Compounds For Combating Arthropod Pests and Nematodes C5, CHRM1, ACHE CHRNB2 679/4885CHRNA4 300/4885SLC6A2 3227/4885

“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.