SCHEMBL7508741

SCHEMBL7508741

Cc1csc(=N)n1Cc1ccc(Cl)nc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNA1 P02708 2/20 0.55
CHRNA7 P36544 2/20 0.55
CHRNB2 P17787 1/20 0.55
CHRNA4 P43681 1/20 0.55
LMNA P02545 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
AR P10275 1/20 0.43
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HCRTR2 O43614 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
SCHEMBL7499966 0.87 GABRA1 (0.39) CHRNA1CHRNA7CHRNB2CHRNA4LMNA
SCHEMBL7116775 0.86 CHRNA1 (0.46) CHRNA1CHRNA7CHRNB2CHRNA4LMNA
SCHEMBL7507181 0.83 CHRNA1 (0.52) CHRNA1CHRNA7CHRNB2CHRNA4LMNA
SCHEMBL7503621 0.83 CYP11B1 (0.41) CHRNA1CHRNA7CHRNB2CHRNA4LMNA
SCHEMBL7497459 0.83 CYP11B1 (0.41) CHRNA1CHRNA7CHRNB2CHRNA4LMNA
SCHEMBL7503875 0.79 GAA (0.37) CHRNA1CHRNA7CHRNB2CHRNA4LMNA
SCHEMBL6331195 0.79 LMNA (0.45) CHRNA1CHRNA7CHRNB2CHRNA4LMNA
SCHEMBL7503669 0.79 CHRNA7 (0.50) CHRNA1CHRNA7CHRNB2CHRNA4GAA
SCHEMBL6331196 0.79 LMNA (0.45) CHRNA1CHRNA7CHRNB2CHRNA4LMNA
SCHEMBL7500880 0.79 CHRNA1 (0.50) CHRNA1CHRNA7CHRNB2CHRNA4AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1198803-C Heterocyclic compounds having effect of activating nicoting acetylchloine alpha 4 beta 2 receptor FIRST SUNTORY PHARMACEUTICAL L (JP) 2005-04-27 CN claimed
CN-1349506-A Heterocyclic compounds having effect of activating nicoting acetylchloine alpha 4 beta 2 receptor SUNTORY LTD (JP) 2002-05-15 CN claimed
EP-0970050-B1 PROCESS FOR THE PREPARATION OF 10,11-DIHYDRO-5H-DIBENZO A,D]CYCLOHEPT-5-ENES AND DERIVATIVES THEREOF ROLABO SL (ES) 2001-10-24 EP claimed
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
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
CN-1332726-A Pyrrolidine compounds and pharmaceutical use thereof YOSHITOMI PHARMACEUTICAL (JP) 2002-01-23 CN 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
US-4551451-A Tricyclic derivatives of 5,6-dihydro-11H-dibenzo (b,e) azepin-6-one having pharmacological activity A. MENARINI S.A.S. (IT) 1985-11-05 US disclosed
US-4551451-A Tricyclic derivatives of 5,6-dihydro-11H-dibenzo (b,e) azepin-6-one having pharmacological activity A. MENARINI S.A.S. (IT) 1985-11-05 US disclosed
EP-0089322-A1 Tricyclic derivatives of 5,6-dihydro-11H-dibenzo(B,E)azepin-6-one having pharmacological avtivity, and method for their preparation A. Menarini S.a.S. (IT) 1983-09-21 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 CHRNA1 6/4885CHRNA7 2/4885CHRNB2 3/4885

“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.