SCHEMBL4234086

SCHEMBL4234086

CC(C)CCN1CC=C(CCc2ccc(C(=O)O)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 9/20 0.44
PTGER2 P43116 9/20 0.44
SLC6A4 P31645 4/20 0.40
GRIN2D O15399 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SLC6A2 P23975 3/20 0.38
SLC6A3 Q01959 3/20 0.38
MAPK1 P28482 1/20 0.37
DRD1 P21728 1/20 0.36
EBP Q15125 1/20 0.35
SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL4238906 0.88 PTGER4 (0.41) PTGER4PTGER2HRH3ALDH1A1
SCHEMBL4233494 0.84 RARB (0.48) PTGER4PTGER2ALDH1A1
SCHEMBL4233519 0.80 SIGMAR1 (0.53) SIGMAR1
SCHEMBL4237159 0.79 S1PR1 (0.47) PTGER4PTGER2HRH3ALDH1A1
SCHEMBL4234084 0.77 MAPK1 (0.41) PTGER4PTGER2SLC6A4ALDH1A1SLC6A2
SCHEMBL104594 0.71 GRIN2D (0.57) GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1
SCHEMBL24370665 0.68 GRIN2D (0.71) GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1
SCHEMBL20421054 0.68 HDAC1 (0.46) PTGER4PTGER2GRIN2DGRIN2AGRIN2B
SCHEMBL27366899 0.67 GRIN2D (0.53) GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1
Dimethylamine SCHEMBL1401396 0.67 GRIN2D (0.53) GRIN2DGRIN2AGRIN2BGRIN2CALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R PTGER4 467/4885PTGER2 600/4885SLC6A4 438/4885

“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.