SCHEMBL13850486

SCHEMBL13850486

CC(C)CN1C(=O)N(CCc2ccc(O)cc2)C2(CCN(Cc3cccc(CC=O)c3)CC2)C1=O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 5/20 0.38
CCR8 P51685 1/20 0.36
LMNA P02545 1/20 0.35
CCR3 P51677 1/20 0.35
OPRM1 P35372 2/20 0.34
ARRB1 P49407 1/20 0.34
CCR5 P51681 8/20 0.34
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL2913042 0.80 CCR8 (0.42) MCHR1CCR8OPRM1CCR5ALDH1A1
SCHEMBL2449927 0.80 CCR8 (0.52) MCHR1CCR8OPRM1ALDH1A1L3MBTL1
SCHEMBL13850492 0.79 ENPP2 (0.36) MCHR1OPRM1ARRB1ALDH1A1SIGMAR1
SCHEMBL2915758 0.78 CCR8 (0.42) MCHR1CCR8OPRM1CCR5ALDH1A1
SCHEMBL13850491 0.78 HTR1A (0.40) MCHR1LMNAOPRM1ALDH1A1SIGMAR1
SCHEMBL2915410 0.78 MEN1 (0.45) CCR8LMNAALDH1A1L3MBTL1
SCHEMBL2942975 0.78 SIGMAR1 (0.48) MCHR1CCR8OPRM1CCR5SIGMAR1
SCHEMBL14447691 0.76 EP300 (0.37) ALDH1A1
SCHEMBL2481242 0.76 SIGMAR1 (0.43) MCHR1LMNAOPRM1CCR5SIGMAR1
SCHEMBL2452541 0.75 CCR8 (0.47) MCHR1CCR8OPRM1CCR5SIGMAR1

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-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2009-05-28 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-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS PPARD, PPARG, PPARA MCHR1 4317/4885CCR8 1387/4885LMNA 2231/4885

“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.