SCHEMBL4235481

SCHEMBL4235481

O=C(O)Cc1ccc2c(ccn2CCCN2CCC(O)CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
DRD3 P35462 1/20 0.45
P2RX7 Q99572 2/20 0.40
PPARG P37231 1/20 0.40
NR1H2 P55055 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
NR1H3 Q13133 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MCHR2 Q969V1 1/20 0.38
MCHR1 Q99705 1/20 0.38
ABCB1 P08183 1/20 0.38
ESRRG P62508 2/20 0.38
ALOX5 P09917 1/20 0.38
EPHX2 P34913 1/20 0.38

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
SCHEMBL4238803 0.87 ESRRG (0.48) DRD2DRD4DRD3P2RX7PPARG
SCHEMBL4228976 0.84 DRD4 (0.46) DRD2DRD4DRD3P2RX7MCHR2
SCHEMBL4240678 0.80 ESRRG (0.50) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL4228624 0.78 KDM4E (0.47) PPARGNR1H2PPARDPPARANR1H3
SCHEMBL4233525 0.76 DRD2 (0.51) DRD2KDM4EALDH1A1MAPTHPGD
SCHEMBL4236255 0.70 ESRRG (0.58) DRD2DRD4DRD3P2RX7KDM4E
SCHEMBL27602809 0.70 KDM4E (0.53) PPARGNR1H2PPARDPPARANR1H3
SCHEMBL30298362 0.69 CDK4 (0.59) DRD2DRD4DRD3P2RX7HSD17B10
SCHEMBL4237709 0.69 KDM4E (0.46) DRD2KDM4EALDH1A1MAPTHPGD
SCHEMBL5094204 0.69 KDM4E (0.58) KDM4EALDH1A1MAPTHPGDHSD17B10

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 DRD2 337/4885DRD4 423/4885DRD3 384/4885

“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.