SCHEMBL4237709

SCHEMBL4237709

CN1CCC(n2ccc3cc(CC(=O)O)ccc32)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 3/20 0.46
HSD17B10 Q99714 3/20 0.46
MAPT P10636 1/20 0.46
NOS3 P29474 5/20 0.45
NOS1 P29475 5/20 0.45
NOS2 P35228 4/20 0.45
HTR1A P08908 1/20 0.45
HTR1D P28221 1/20 0.45
HTR1B P28222 1/20 0.45
HTR1F P30939 1/20 0.45
HTR2A P28223 2/20 0.43
HTR7 P34969 2/20 0.43
KCNH2 Q12809 1/20 0.43
DRD2 P14416 1/20 0.42
SLC6A4 P31645 1/20 0.42
TSHR P16473 1/20 0.41
AURKA O14965 1/20 0.39
CDK4 P11802 1/20 0.39

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
SCHEMBL4233525 0.86 DRD2 (0.51) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL4228613 0.81 HTR1A (0.53) HSD17B10NOS3NOS1NOS2HTR1A
SCHEMBL8416065 0.77 NOS3 (0.48) NOS3NOS1NOS2HTR1AHTR1D
SCHEMBL10512721 0.77 NOS3 (0.43) NOS3NOS1NOS2HTR1AHTR1D
SCHEMBL27544242 0.77 NOS3 (0.51) KDM4EALDH1A1NOS3NOS1NOS2
SCHEMBL26408392 0.76 NOS3 (0.49) MAPTNOS3NOS1NOS2HTR1A
SCHEMBL5094204 0.75 KDM4E (0.58) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL2266494 0.74 PRKCI (0.51) NOS3NOS1NOS2HTR1AHTR1D
SCHEMBL6589098 0.74 HTR1A (0.54) NOS3NOS1NOS2HTR1AHTR1D
SCHEMBL6789672 0.74 SCD (0.55) NOS3NOS1NOS2HTR1AHTR1D

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 KDM4E 1604/4885ALDH1A1 4542/4885HPGD 1474/4885

“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.