SCHEMBL4120112

SCHEMBL4120112

O=C(O)Cc1cccc(N2CCC3(CC2)C(=O)N(CC2CCCCC2)C(=O)N3Cc2ccc(OC(F)(F)F)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 11/20 0.45
FFAR4 Q5NUL3 1/20 0.43
HRH1 P35367 1/20 0.42
CCR3 P51677 1/20 0.42
KCNH2 Q12809 1/20 0.42
GCGR P47871 2/20 0.42
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
CRHBP P24387 2/20 0.39
CRHR2 Q13324 2/20 0.39
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 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
SCHEMBL2918305 0.99 CHRM4 (0.45) CHRM4FFAR4HRH1CCR3KCNH2
SCHEMBL2917310 0.98 CHRM4 (0.45) CHRM4FFAR4HRH1CCR3KCNH2
SCHEMBL2916320 0.96 CHRM4 (0.46) CHRM4FFAR4HRH1CCR3KCNH2
SCHEMBL2916220 0.93 CHRM4 (0.46) CHRM4FFAR4HRH1CCR3KCNH2
SCHEMBL2918388 0.92 FFAR4 (0.47) CHRM4FFAR4HRH1CCR3KCNH2
SCHEMBL2914958 0.89 ITGB3 (0.41) CHRM4HRH1CCR3KCNH2CHRM2
SCHEMBL13212985 0.88 ITGB3 (0.42) FFAR4HRH1CCR3KCNH2ITGB3
SCHEMBL4124559 0.88 CHRM4 (0.39) CHRM4FFAR4HRH1CCR3KCNH2
SCHEMBL2909717 0.88 ITGB3 (0.41) CHRM4HRH1CCR3KCNH2CHRM2
SCHEMBL2917223 0.87 CHRM4 (0.43) CHRM4FFAR4GCGRCHRM2CHRM1

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-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2009-05-28 US claimed
US-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2009-05-28 US disclosed
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 CHRM4 2743/4885FFAR4 207/4885HRH1 3688/4885

“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.