SCHEMBL5565041

SCHEMBL5565041

CCc1cc(CCCc2ccc(CO)c(CO)c2)ccc1OCC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.51
MAPT P10636 1/20 0.51
TSHR P16473 1/20 0.45
ELANE P08246 4/20 0.44
F2 P00734 1/20 0.44
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
CTSG P08311 1/20 0.42
TP53 P04637 1/20 0.41
MDM2 Q00987 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
BCL2L1 Q07817 1/20 0.40
MCL1 Q07820 1/20 0.40
GLA P06280 1/20 0.40
LTB4R Q15722 1/20 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
SCHEMBL5569702 0.88 FFAR4 (0.48) PTGDR2MAPTPPARGPPARA
SCHEMBL5650180 0.84 PTGDR2 (0.56) PTGDR2MAPTELANEF2CTSG
SCHEMBL11847623 0.84 PPARA (0.59) PTGDR2MAPTTSHRELANEF2
SCHEMBL5565048 0.82 PPARA (0.44) PTGDR2MAPTTSHRELANEF2
SCHEMBL8166807 0.80 TSHR (0.61) PTGDR2MAPTTSHRPPARGPPARA
SCHEMBL5564687 0.80 VDR (0.41) MAPTL3MBTL1
SCHEMBL5569478 0.79 FFAR4 (0.39) PPARGPPARA
SCHEMBL5565702 0.79 ALDH1A1 (0.34) MAPTL3MBTL1
SCHEMBL6386984 0.79 LTB4R (0.41) PTGDR2PPARGPPARALTB4R
SCHEMBL5696303 0.78 TSHR (0.64) PTGDR2MAPTTSHRPPARGPPARA

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-7312249-B2 Vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-12-25 US disclosed
EP-1537065-B1 ANALOGUES OF VITAMIN D GALDERMA RES & DEV (FR) 2006-11-02 EP disclosed
US-20050182144-A1 Novel vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-08-18 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-20050182144-A1 Novel vitamin D analogues CYP24A1, CYP2R1, VDR PTGDR2 77/4885MAPT 3928/4885TSHR 816/4885

“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.