SCHEMBL1497423

SCHEMBL1497423

N#CC1C2CC3CC1CC(N)(C3)C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
GRIN1 Q05586 3/20 0.50
GRIN2A Q12879 3/20 0.50
SLC22A1 O15245 2/20 0.50
GRIN2D O15399 2/20 0.50
GRIN3B O60391 2/20 0.50
NFKB1 P19838 2/20 0.50
GRIN2B Q13224 2/20 0.50
GRIN2C Q14957 2/20 0.50
GRIN3A Q8TCU5 2/20 0.50
SLC22A2 O15244 1/20 0.50
TSHR P16473 1/20 0.50
STAT6 P42226 1/20 0.50
SLC47A1 Q96FL8 1/20 0.50
SIGMAR1 Q99720 1/20 0.50
THRB P10828 2/20 0.48
PMP22 Q01453 2/20 0.48
POLB P06746 1/20 0.48
BLM P54132 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL12832297 1.00 LMNA (0.50) LMNAGRIN1GRIN2ASLC22A1GRIN2D
SCHEMBL13968155 0.79 LMNA (0.52) LMNAGRIN1GRIN2ASLC22A1GRIN2D
SCHEMBL20245083 0.78 GRIN1 (0.71) LMNAGRIN1GRIN2ASLC22A1GRIN2D
Hydrochloric Acid SCHEMBL13834367 0.78 LMNA (0.54) LMNAGRIN1GRIN2ASLC22A1GRIN2D
SCHEMBL14942936 0.74
SCHEMBL22660046 0.74 DPP4 (0.39)
SCHEMBL12765620 0.74
SCHEMBL22660043 0.74 DPP4 (0.39)
SCHEMBL12765562 0.74
SCHEMBL12765564 0.74 DPP4 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440720-B2 Methods of use of antiviral compounds INFLUMEDIX, INC. (US) 2013-05-14 US disclosed
US-8440720-B2 Methods of use of antiviral compounds INFLUMEDIX, INC. (US) 2013-05-14 US disclosed
US-8440720-B2 Methods of use of antiviral compounds INFLUMEDIX, INC. (US) 2013-05-14 US disclosed
US-20110065766-A1 METHODS OF USE OF ANTIVIRAL COMPOUNDS INFLUMEDIX, INC. 2011-03-17 US disclosed
US-20110065766-A1 METHODS OF USE OF ANTIVIRAL COMPOUNDS INFLUMEDIX, INC. 2011-03-17 US disclosed
US-20110065766-A1 METHODS OF USE OF ANTIVIRAL COMPOUNDS INFLUMEDIX, INC. 2011-03-17 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-20110065766-A1 METHODS OF USE OF ANTIVIRAL COMPOUNDS MAVS, SLC30A5, HAVCR2 LMNA 1701/4885GRIN1 2482/4885GRIN2A 2171/4885

“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.