SCHEMBL864305

SCHEMBL864305

CC(CC=O)CN1CCC(CO)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
MAPK8 P45983 1/20 0.32
MAPK10 P53779 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.32
HTT P42858 1/20 0.32
LTA4H P09960 1/20 0.31
SLC6A3 Q01959 3/20 0.30
KCNH2 Q12809 1/20 0.30

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
SCHEMBL623089 0.79 HRH3 (0.35) GRIN2DGRIN3BADRA1DADRA1AADRA1B
SCHEMBL25217644 0.77 GAA (0.42) MEN1LMNAKMT2A
SCHEMBL13683795 0.76 PIK3CD (0.44) GRIN2DGRIN3BADRA1DADRA1AADRA1B
SCHEMBL459379 0.72 CHRM1 (0.40) HRH3LMNAKCNH2CACNA1I
SCHEMBL4342319 0.72 LTA4H (0.36) HRH3LTA4H
SCHEMBL16052475 0.72
SCHEMBL18666615 0.69 LTA4H (0.37) HRH3LTA4H
SCHEMBL24607220 0.68 PIK3CD (0.40) HRH3KCNH2CACNA1I
SCHEMBL14735626 0.67 PTPN1 (0.33) HRH3KCNH2
SCHEMBL1381371 0.66 GBA1 (0.40) GRIN2DGRIN3BADRA1DADRA1AADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077793-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-29 US disclosed
EP-2406247-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Prosidion Limited (GB) 2012-01-18 EP disclosed
WO-2010103333-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-09-16 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-20120077793-A1 Compounds for the Treatment of Metabolic Disorders GPR119, GPR132, FFAR2 GRIN2D 2454/4885GRIN3B 1339/4885ADRA1D 166/4885

“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.