SCHEMBL2914958

SCHEMBL2914958

O=C(O)Cc1cccc(N2CCC3(CC2)C(=O)N(CC2CCCC2)C(=O)N3Cc2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 2/20 0.41
ITGA2B P08514 2/20 0.41
TACR1 P25103 4/20 0.40
KCNH2 Q12809 3/20 0.39
HRH1 P35367 1/20 0.39
CCR3 P51677 1/20 0.39
HSD11B1 P28845 2/20 0.39
CHRM4 P08173 3/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
EBP Q15125 2/20 0.37
SIGMAR1 Q99720 2/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
CHRM2 P08172 1/20 0.36

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
SCHEMBL2909717 0.98 ITGB3 (0.41) ITGB3ITGA2BTACR1KCNH2HRH1
SCHEMBL2910510 0.92 SIGMAR1 (0.38) ITGB3ITGA2BTACR1KCNH2HRH1
SCHEMBL13212510 0.91 OPRL1 (0.41) TACR1KCNH2HSD11B1CHRM4CYP3A4
SCHEMBL2915435 0.91 SIGMAR1 (0.38) ITGB3ITGA2BTACR1KCNH2HRH1
SCHEMBL2914627 0.90 TACR1 (0.37) ITGB3ITGA2BTACR1KCNH2HRH1
SCHEMBL2918305 0.90 CHRM4 (0.45) ITGB3ITGA2BKCNH2HRH1CCR3
SCHEMBL13212985 0.90 ITGB3 (0.42) ITGB3ITGA2BTACR1KCNH2HRH1
SCHEMBL4120112 0.89 CHRM4 (0.45) ITGB3ITGA2BKCNH2HRH1CCR3
SCHEMBL2917310 0.88 CHRM4 (0.45) ITGB3ITGA2BKCNH2HRH1CCR3
SCHEMBL2916320 0.87 CHRM4 (0.46) ITGB3ITGA2BKCNH2HRH1CCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1979355-B1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2010-08-18 EP claimed
US-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2009-05-28 US claimed
EP-1979355-A1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2008-10-15 EP claimed
WO-2007087448-A1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2007-08-02 WO claimed
EP-1979355-B1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2010-08-18 EP disclosed
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
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 ITGB3 2615/4885ITGA2B 2707/4885TACR1 657/4885

“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.