SCHEMBL5569733

SCHEMBL5569733

COCOc1ccc(CCCc2ccc(C(=O)O)c(C(=O)O)c2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.46
PPARG P37231 1/20 0.46
FFAR4 Q5NUL3 10/20 0.45
FFAR1 O14842 6/20 0.44
HPGD P15428 1/20 0.43
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
CLCN2 P51788 1/20 0.40
KAT8 Q9H7Z6 2/20 0.40
RARB P10826 1/20 0.40
FFAR2 O15552 1/20 0.39
CFD P00746 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
SCHEMBL5569801 0.81 VDR (0.53) PPARAPPARGFFAR4FFAR1
SCHEMBL254346 0.77 KAT8 (0.54) PPARAPPARGKAT8RARB
SCHEMBL5569783 0.76 KAT8 (0.57) PPARAPPARGKAT8RARB
SCHEMBL5568404 0.76 ALDH1A1 (0.41) PPARAPPARGFFAR4FFAR1HPGD
SCHEMBL5568363 0.75 PPARA (0.44) PPARAPPARGKAT8RARBCFD
SCHEMBL334154 0.73 FFAR4 (0.40) FFAR4FFAR1HPGD
SCHEMBL8159417 0.72 KAT8 (0.62) PPARAPPARGKAT8RARB
SCHEMBL2687820 0.72 KAT8 (0.62) PPARAPPARGKAT8RARB
SCHEMBL10397857 0.71 PPARG (0.58) PPARAPPARGHPGDPDE4APDE4B
SCHEMBL7071495 0.71 HDAC1 (0.50) PPARAKAT8

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 5 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
EP-1537065-A1 ANALOGUES OF VITAMIN D Galderma Research & Development, S.N.C. (FR) 2005-06-08 EP disclosed
WO-2004020379-A1 ANALOGUES OF VITAMIN D GALDERMA RESEARCH & DEVELOPMENT, SNC (FR) 2004-03-11 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-20050182144-A1 Novel vitamin D analogues CYP24A1, CYP2R1, VDR PPARA 134/4885PPARG 57/4885FFAR4 347/4885

“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.