SCHEMBL720104

SCHEMBL720104

CN1CCc2cc3[nH]c(=O)n(C)c3cc2CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
DAO P14920 1/20 0.50
PGR P06401 2/20 0.40
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
BRCA1 P38398 1/20 0.38
MEN1 O00255 1/20 0.37
PABPC1 P11940 1/20 0.37
KMT2A Q03164 1/20 0.37
GRIA1 P42261 1/20 0.37
GRIA2 P42262 1/20 0.37
GRIA3 P42263 1/20 0.37
GRIA4 P48058 1/20 0.37
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36

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
SCHEMBL720699 0.85 LMNA (0.51) LMNADAOPGRMEN1PABPC1
SCHEMBL721460 0.77 LMNA (0.52) LMNADAOPGRTSHRMEN1
SCHEMBL31276413 0.74 LMNA (0.47) LMNADAOPGRMEN1PABPC1
SCHEMBL15730579 0.71 GRIA1 (0.68) LMNAPGRTSHRMEN1PABPC1
SCHEMBL6651292 0.71 LMNA (0.59) LMNADAOPGRMEN1PABPC1
SCHEMBL13015581 0.68 LMNA (0.56) LMNAPGRKMT2AGRIN2DGRIN3B
SCHEMBL12705960 0.67 DRD2 (0.54) MAOB
SCHEMBL9833158 0.67 LMNA (0.50) LMNADAOPGRMEN1PABPC1
SCHEMBL31731190 0.67 LMNA (0.54) LMNADAOPGRMEN1PABPC1
SCHEMBL25681022 0.67 ATAD2 (0.55) LMNADAOPGRMEN1PABPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053168-A1 FUSED BENZOAZEPINES AS NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS TARGACEPT, INC. (US) 2012-03-01 US claimed
US-20120053168-A1 FUSED BENZOAZEPINES AS NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS TARGACEPT, INC. (US) 2012-03-01 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-20120053168-A1 FUSED BENZOAZEPINES AS NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA2, CHRNA5, CHRNA10 LMNA 1768/4885DAO 2062/4885PGR 2196/4885

“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.