SCHEMBL5023091

SCHEMBL5023091

CCOc1ccc(N(CC)C(=O)COc2ccc(CC(OC)C(=O)OC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OXTR P30559 2/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
ACACB O00763 5/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
PPARA Q07869 2/20 0.40
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40

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
SCHEMBL5024524 0.90 MEN1 (0.52) OXTRMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL14285167 0.85 ACACB (0.53) ACACBGAARAB9APPARAPPARG
SCHEMBL14285179 0.85 ACACB (0.53) ACACBGAARAB9APPARAPPARG
SCHEMBL5027071 0.84 MEN1 (0.51) OXTRMEN1KMT2APPARAPPARG
SCHEMBL6148806 0.83 MEN1 (0.61) MEN1KMT2APPARAPPARGPPARD
SCHEMBL5360759 0.82 PPARA (0.49) OXTRMEN1KMT2APPARAPPARG
SCHEMBL5364857 0.81 PPARA (0.65) OXTRMEN1KMT2ASMN1; SMN2PPARA
SCHEMBL5028810 0.78 PPARA (0.51) MEN1KMT2AMAPTSMN1; SMN2PPARA
SCHEMBL14285180 0.78 PPARA (0.51) MEN1KMT2AMAPTSMN1; SMN2PPARA
SCHEMBL5028808 0.78 PPARA (0.51) MEN1KMT2AMAPTSMN1; SMN2PPARA

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-7321056-B2 Selective peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2008-01-22 US disclosed
EP-1697306-B1 SELECTIVE PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2007-07-25 EP disclosed
US-20070066683-A1 Selective peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY 2007-03-22 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-20070066683-A1 Selective peroxisome proliferator activated receptor modulators PPARG, PPARD, PPARA OXTR 1855/4885MEN1 4850/4885KMT2A 3261/4885

“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.