SCHEMBL733210

SCHEMBL733210

CN(CCC#N)Cc1cccnc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.63
CHRNA4 P43681 3/20 0.63
RECQL P46063 1/20 0.51
CHRNA7 P36544 1/20 0.50
ALDH1A1 P00352 8/20 0.47
LMNA P02545 3/20 0.47
KDM4E B2RXH2 3/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 2/20 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
SCHEMBL13970334 0.82 CHRNB2 (0.55) CHRNB2CHRNA4RECQLCHRNA7ALDH1A1
SCHEMBL10028665 0.81 CHRNB2 (0.85) CHRNB2CHRNA4CHRNA7ALDH1A1LMNA
SCHEMBL13949621 0.81 CHRNB2 (0.49) CHRNB2CHRNA4RECQLCHRNA7ALDH1A1
SCHEMBL16627431 0.80 CHRNB2 (0.77) CHRNB2CHRNA4CHRNA7ALDH1A1LMNA
SCHEMBL153688 0.80 CARM1 (0.58) ALDH1A1LMNASMN1; SMN2
SCHEMBL9827841 0.79 CHRNB2 (0.69) CHRNB2CHRNA4CHRNA7ALDH1A1LMNA
SCHEMBL4862940 0.79 CHRNB2 (0.69) CHRNB2CHRNA4CHRNA7ALDH1A1LMNA
SCHEMBL14276859 0.79 RECQL (0.64) CHRNB2CHRNA4RECQLALDH1A1LMNA
SCHEMBL6674571 0.78 CHRNB2 (1.00) CHRNB2CHRNA4CHRNA7ALDH1A1LMNA
SCHEMBL31044635 0.78 CHRNB2 (1.00) CHRNB2CHRNA4CHRNA7ALDH1A1LMNA

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
US-8138173-B2 Pyrazolo[3,4-C]quinolines, pyrazolo[3,4-C]naphthyridines, analogs thereof, and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-03-20 US disclosed
US-8138173-B2 Pyrazolo[3,4-C]quinolines, pyrazolo[3,4-C]naphthyridines, analogs thereof, and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-03-20 US disclosed
US-20090069299-A1 Pyrazolo[3,4-c]Quinolines, Pyrazolo[3,4-c]Naphthyridines, Analogs Thereof, and Methods COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-03-12 US disclosed
US-20090069299-A1 Pyrazolo[3,4-c]Quinolines, Pyrazolo[3,4-c]Naphthyridines, Analogs Thereof, and Methods COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-03-12 US disclosed
US-5138062-A Tranquilizers PHILIP MORRIS INCORPORATED 1992-08-11 US disclosed
US-5015741-A Insecticides, aphidicides, psychological disorders, sedatives or tranquilizers PHILIP MORRIS INCORPORATED (US) 1991-05-14 US disclosed
EP-0421762-A1 Novel nicotine analogs and method Philip Morris Products Inc. (US) 1991-04-10 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-20090069299-A1 Pyrazolo[3,4-c]Quinolines, Pyrazolo[3,4-c]Naphthyridines, Analogs Thereof, and Methods IL4, IL2, IL5 CHRNB2 3990/4885CHRNA4 1670/4885RECQL 542/4885

“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.