SCHEMBL6640495

SCHEMBL6640495

Cc1nc(N)n(CCc2ccc(Cl)nc2)c1C

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CHRNA1 P02708 1/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA7 P36544 1/20 0.38
CHRNA4 P43681 1/20 0.38
KMT2A Q03164 1/20 0.38
AR P10275 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
SCHEMBL7505067 0.86 LMNA (0.48) LMNAL3MBTL1CHRNA1CHRNB2CHRNA3
SCHEMBL7123364 0.71 CHRNA1 (0.43) LMNAL3MBTL1CHRNA1CHRNB2CHRNA7
SCHEMBL6639142 0.70 LMNA (0.52) LMNAL3MBTL1CHRNA1CHRNB2CHRNA3
SCHEMBL27486788 0.69 POLB (0.42) CHRNB2CHRNA3CHRNA4KMT2A
SCHEMBL7116775 0.69 CHRNA1 (0.46) LMNAL3MBTL1CHRNA1CHRNB2CHRNA7
SCHEMBL21324401 0.68 LMNA (0.40) LMNAL3MBTL1KMT2A
SCHEMBL6788044 0.66 ALDH1A1 (0.49) LMNAL3MBTL1
SCHEMBL165097 0.66 TAAR1 (0.52) L3MBTL1CHRNA7
SCHEMBL7508721 0.66 LMNA (0.55) LMNAL3MBTL1CHRNA1CHRNB2CHRNA3
SCHEMBL4624381 0.65 GAA (0.43) LMNAL3MBTL1CHRNA1CHRNB2CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1185521-B1 SUBSTITUTED 1-AZA-2-IMINO-HETEROCYCLES AND THEIR USE AS ACTIVATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS DAIICHI SUNTORY PHARMA CO LTD (JP) 2004-10-06 EP claimed
US-20030134848-A1 Substituted 1-aza-2-imino-heterocycles and their use as nicotinic acetylcholin receptors activators DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2003-07-17 US claimed
EP-1185521-B1 SUBSTITUTED 1-AZA-2-IMINO-HETEROCYCLES AND THEIR USE AS ACTIVATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS DAIICHI SUNTORY PHARMA CO LTD (JP) 2004-10-06 EP disclosed
US-20030134848-A1 Substituted 1-aza-2-imino-heterocycles and their use as nicotinic acetylcholin receptors activators DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2003-07-17 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-20030134848-A1 Substituted 1-aza-2-imino-heterocycles and their use as nicotinic acetylcholin receptors activators CHRNA7, CHRNA2, CHRNA1 LMNA 3142/4885L3MBTL1 3835/4885CHRNA1 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.