SCHEMBL10106209

SCHEMBL10106209

CCCCCc1cccc(Oc2ccc(Cl)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
FDFT1 P37268 3/20 0.53
PPARA Q07869 6/20 0.51
PPARG P37231 5/20 0.51
LMNA P02545 1/20 0.47
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
CETP P11597 1/20 0.46
LPL P06858 1/20 0.45
LIPG Q9Y5X9 1/20 0.45

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
SCHEMBL13406682 0.89 ALDH1A1 (0.59) ALDH1A1FDFT1PPARAPPARGLMNA
SCHEMBL10106193 0.87 PPARA (0.60) FDFT1PPARAPPARGCETP
SCHEMBL27830388 0.87 PPARA (0.63) PPARAPPARGCETPLPLLIPG
SCHEMBL28547948 0.87 PPARA (0.63) PPARAPPARGCETPLPLLIPG
SCHEMBL9819438 0.87 PPARA (0.63) PPARAPPARGCETPLPLLIPG
SCHEMBL29693068 0.87 PPARA (0.63) PPARAPPARGCETPLPLLIPG
SCHEMBL176242 0.87 PPARA (0.63) PPARAPPARGCETPLPLLIPG
SCHEMBL10106203 0.86 FDFT1 (0.58) FDFT1PPARAPPARGCETPLPL
SCHEMBL10106213 0.86 PPARA (0.52) FDFT1PPARAPPARGCETPLPL
SCHEMBL23085167 0.86 PPARA (0.62) PPARAPPARGCETPLPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120022024-A1 ANTI-BACTERIAL COMPOSITIONS AND METHODS INCLUDING TARGETING VIRULENCE FACTORS OF STAPHYLOCOCCUS AUREUS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-01-26 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-20120022024-A1 ANTI-BACTERIAL COMPOSITIONS AND METHODS INCLUDING TARGETING VIRULENCE FACTORS OF STAPHYLOCOCCUS AUREUS CUTA, MMP8, CLPP ALDH1A1 4784/4885FDFT1 1987/4885PPARA 3798/4885

“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.