SCHEMBL2917141

SCHEMBL2917141

COC(=O)C(C)c1ccc(C(CCc2ccc(OC)cc2)C2CCCC3(C2)NC(=O)N(CC(C)C)C3=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.40
AKR1B1 P15121 1/20 0.39
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA4 P22748 2/20 0.36
CA5A P35218 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
LMNA P02545 4/20 0.35
HTT P42858 2/20 0.35
RAB9A P51151 1/20 0.35
CA5B Q9Y2D0 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL2919374 0.93 NPC1 (0.38) NPC1AKR1B1CA12CA1CA2
SCHEMBL2917139 0.71 MMP1 (0.35) HTTKMT2AMEN1ALDH1A1
SCHEMBL13849464 0.66 CYP3A4 (0.38) KMT2AMEN1ALDH1A1
SCHEMBL2913047 0.65 MEN1 (0.40) NPC1AKR1B1LMNAKMT2AMEN1
SCHEMBL2912996 0.65 ALDH1A1 (0.39) NPC1AKR1B1LMNAKMT2AMEN1
SCHEMBL2911536 0.64 PTGS1 (0.37) HTTKMT2AALDH1A1
SCHEMBL4007061 0.62 MEN1 (0.54) CA1CA2RAB9AKMT2AMEN1
SCHEMBL11578478 0.61 PTGS2 (0.46) LMNAKMT2A
SCHEMBL19095281 0.60 KMT2A (0.73) NPC1AKR1B1LMNAHTTRAB9A
SCHEMBL30747380 0.60 HTT (0.52) NPC1AKR1B1LMNAHTTRAB9A

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 4 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 disclosed
US-20090137610-A1 SPIRO IMIDOZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2009-05-28 US disclosed
EP-1979355-A1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2008-10-15 EP disclosed
WO-2007087448-A1 SPIRO IMIDAZOLE DERIVATIVES AS PPAR MODULATORS IRM LLC (BM) 2007-08-02 WO 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 NPC1 831/4885AKR1B1 202/4885CA12 4877/4885

“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.