SCHEMBL22924948

SCHEMBL22924948

CCCCCCCC(C)(CCCCCCC)C(=O)NO

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.47
CES2 O00748 1/20 0.42
EPHX1 P07099 2/20 0.41
GGPS1 O95749 6/20 0.41
MMP1 P03956 1/20 0.40
MMP9 P14780 1/20 0.40
MMP13 P45452 1/20 0.40
FDPS P14324 8/20 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
SCHEMBL19618122 1.00 HSP90AA1 (0.47) HSP90AA1CES2EPHX1GGPS1MMP1
SCHEMBL25873397 1.00 HSP90AA1 (0.47) HSP90AA1CES2EPHX1GGPS1MMP1
SCHEMBL19779064 0.92 HSP90AA1 (0.44) HSP90AA1CES2EPHX1GGPS1MMP1
SCHEMBL20915524 0.92 HSP90AA1 (0.44) HSP90AA1CES2EPHX1GGPS1MMP1
SCHEMBL20915567 0.92 HSP90AA1 (0.44) HSP90AA1CES2EPHX1GGPS1MMP1
SCHEMBL20915350 0.92 HSP90AA1 (0.44) HSP90AA1CES2EPHX1GGPS1MMP1
SCHEMBL20936616 0.92 HSP90AA1 (0.44) HSP90AA1CES2EPHX1GGPS1MMP1
SCHEMBL20915530 0.92 HSP90AA1 (0.44) HSP90AA1CES2EPHX1GGPS1MMP1
SCHEMBL20936509 0.92 HSP90AA1 (0.44) HSP90AA1CES2EPHX1GGPS1MMP1
SCHEMBL20915569 0.83 KDM4E (0.48) HSP90AA1CES2EPHX1GGPS1MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11447452-B2 Agonists of peroxisome proliferator-activated receptor alpha and methods of use THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 2022-09-20 US disclosed
US-20210024469-A1 AGONISTS OF PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR ALPHA AND METHODS OF USE THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA 2021-01-28 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 (2 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-20210024469-A1 AGONISTS OF PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR ALPHA AND METHODS OF USE PPARG, PPARA, PPARD HSP90AA1 847/4885CES2 3858/4885EPHX1 1064/4885
US-11447452-B2 Agonists of peroxisome proliferator-activated receptor alpha and methods of use PPARG, PPARA, PPARD HSP90AA1 847/4885CES2 3858/4885EPHX1 1064/4885

“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.