SCHEMBL7504331

SCHEMBL7504331

N=c1sccn1Cc1ccc(Cl)nc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 5/20 1.00
CHRNA4 P43681 5/20 1.00
CHRNA1 P02708 2/20 1.00
CHRNA7 P36544 2/20 1.00
LMNA P02545 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
KMT2A Q03164 1/20 0.50
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL7123376 0.85 CHRNB2 (0.74) CHRNB2CHRNA4CHRNA1CHRNA7LMNA
SCHEMBL7495819 0.82 CHRNB2 (0.69) CHRNB2CHRNA4CHRNA1CHRNA7LMNA
SCHEMBL7501233 0.82 CHRNB2 (0.69) CHRNB2CHRNA4CHRNA1CHRNA7LMNA
SCHEMBL7501821 0.80 CHRNB2 (0.67) CHRNB2CHRNA4CHRNA1CHRNA7L3MBTL1
SCHEMBL6323492 0.79 CHRNB2 (0.65) CHRNB2CHRNA4CHRNA1CHRNA7LMNA
SCHEMBL8184788 0.78 CHRNB2 (0.70) CHRNB2CHRNA4CHRNA1CHRNA7LMNA
SCHEMBL6325147 0.77 CHRNB2 (0.69) CHRNB2CHRNA4CHRNA1CHRNA7LMNA
SCHEMBL6325141 0.77 CHRNB2 (0.69) CHRNB2CHRNA4CHRNA1CHRNA7LMNA
SCHEMBL7506033 0.76 CHRNB2 (0.60) CHRNB2CHRNA4CHRNA1CHRNA7KMT2A
Thiacloprid Olefin SCHEMBL7735960 0.75 CHRNB2 (1.00) CHRNB2CHRNA4CHRNA1CHRNA7LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0857725-B1 (N-(pyridinylmethyl)-heterocyclic)-ylideneamine compounds as nicotinic acetylcholine receptor binding agents PFIZER (US) 2001-07-25 EP claimed
US-6020335-A (N-(pyridinylmethyl)-heterocyclic)ylideneamine compounds as nicotinic acetylcholine receptor binding agents PFIZER INC (US) 2000-02-01 US claimed
EP-0857725-A1 (N-(pyridinylmethyl)-heterocyclic)-ylideneamine compounds as nicotinic acetylcholine receptor binding agents PFIZER INC. (US) 1998-08-12 EP claimed
CN-103068242-A Pest control agent MEIJI SEIKA PHARMA CO LTD 2013-04-24 CN disclosed
US-20020028809-A1 Heterocyclic compounds having effect of activating a4beta2 nicotinic acetylcholine receptors SUNTORY LIMITED 2002-03-07 US disclosed
EP-1176141-A1 HETEROCYCLIC COMPOUNDS HAVING EFFECT OF ACTIVATING NICOTINIC ACETYLCHOLINE $g(a)4$g(b)2 RECEPTOR SUNTORY LIMITED (JP) 2002-01-30 EP disclosed
EP-0857725-B1 (N-(pyridinylmethyl)-heterocyclic)-ylideneamine compounds as nicotinic acetylcholine receptor binding agents PFIZER (US) 2001-07-25 EP disclosed
US-6020335-A (N-(pyridinylmethyl)-heterocyclic)ylideneamine compounds as nicotinic acetylcholine receptor binding agents PFIZER INC (US) 2000-02-01 US disclosed
EP-0857725-A1 (N-(pyridinylmethyl)-heterocyclic)-ylideneamine compounds as nicotinic acetylcholine receptor binding agents PFIZER INC. (US) 1998-08-12 EP disclosed
EP-0639569-A1 NOVEL HETEROCYCLIC COMPOUND NIPPON SODA CO., LTD. (JP) 1995-02-22 EP 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-20020028809-A1 Heterocyclic compounds having effect of activating a4beta2 nicotinic acetylcholine receptors CHRNA2, CHRNA7, CHRNB2 CHRNB2 3/4885CHRNA4 8/4885CHRNA1 6/4885

“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.