SCHEMBL2855045

SCHEMBL2855045

CCCc1cc(C2(CC)OCCO2)ccc1-c1cc(CCc2ccc(C(=O)O)c(C(=O)O)c2)ccc1C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
VDR P11473 1/20 0.39
SORT1 Q99523 1/20 0.34
KAT8 Q9H7Z6 2/20 0.34
PPARA Q07869 2/20 0.34
RARB P10826 2/20 0.34
METAP2 P50579 2/20 0.32
PPARG P37231 1/20 0.32
SPHK2 Q9NRA0 1/20 0.31
MCL1 Q07820 1/20 0.31
RXRA P19793 2/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 1/20 0.30
LCK P06239 1/20 0.30

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
SCHEMBL2857001 0.87 PTPN1 (0.31) RARBRXRARXRBRXRG
SCHEMBL2859703 0.83 VDR (0.58) VDRSPHK2
SCHEMBL3283097 0.78 KAT8 (0.39) SORT1KAT8PPARARARBMETAP2
SCHEMBL6472378 0.76
SCHEMBL6472374 0.75 PTGS2 (0.33)
SCHEMBL6472376 0.75 PTGS2 (0.33)
SCHEMBL6564038 0.71 LCK (0.36) SORT1KAT8PPARARARBMETAP2
SCHEMBL6472371 0.70
SCHEMBL6564995 0.70 LCK (0.35) SORT1KAT8PPARARARBMETAP2
SCHEMBL1355572 0.67 SORT1 (0.56) SORT1KAT8PPARARARBMETAP2

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
EP-1456160-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2010-01-20 EP disclosed
US-6924400-B2 Triaromatic vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT, SNC (FR) 2005-08-02 US disclosed
US-20030195259-A1 Triaromatic vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT (FR) 2003-10-16 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-20030195259-A1 Triaromatic vitamin D analogues CYP24A1, CYP2R1, VDR VDR 3/4885SORT1 2046/4885KAT8 3955/4885

“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.