SCHEMBL6085

SCHEMBL6085

NCC1CCN(C(=O)C2CC2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.45
PLG P00747 1/20 0.44
PLAT P00750 1/20 0.44
LMNA P02545 1/20 0.44
CHRNB2 P17787 5/20 0.42
CHRNA3 P32297 5/20 0.42
CHRNA4 P43681 5/20 0.42
CHRNB3 Q05901 3/20 0.42
CHRNA6 Q15825 3/20 0.42
TP53 P04637 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
CHRNB4 P30926 2/20 0.40
CHRNA7 P36544 2/20 0.40
KDM1A O60341 1/20 0.39
KCNH2 Q12809 1/20 0.39
FASN P49327 2/20 0.38
NCF1 P14598 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 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
SCHEMBL11909770 1.00 HPGD (0.45) HPGDPLGPLATLMNACHRNB2
SCHEMBL6083 1.00 HPGD (0.45) HPGDPLGPLATLMNACHRNB2
SCHEMBL18306308 0.89 HPGD (0.52) HPGDPLGPLATLMNACHRNB2
SCHEMBL102680 0.88 HPGD (0.54) HPGDPLGPLATLMNACHRNB2
SCHEMBL15515214 0.82 CHRNB2 (0.48) HPGDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL15515212 0.82 CHRNB2 (0.48) HPGDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL28468949 0.82 NAMPT (0.42)
SCHEMBL26790983 0.81 HPGD (0.45) HPGDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL11909339 0.81 HPGD (0.45) HPGDCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL2337249 0.80 PLG (0.42) PLGPLATLMNANCF1CHRM2

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
US-20130172384-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED 2013-07-04 US disclosed
EP-2493310-A1 BENZIMIDAZOLES AS FATTY ACID SYNTHASE INHIBITORS GlaxoSmithKline LLC (US) 2012-09-05 EP disclosed
WO-2011066211-A1 AZABENZIMIDAZOLES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-06-03 WO disclosed
WO-2011056635-A1 BENZIMIDAZOLES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-05-12 WO 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-20130172384-A1 FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 HPGD 980/4885PLG 3260/4885PLAT 2530/4885

“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.