SCHEMBL2856534

SCHEMBL2856534

CCCc1cc(C(=O)CC)ccc1-c1cc(OCOCC)ccc1CC

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
VDR P11473 1/20 0.42
PPARG P37231 6/20 0.38
PPARA Q07869 6/20 0.38
ABCB1 P08183 1/20 0.36
RAB9A P51151 3/20 0.35
MAPT P10636 3/20 0.35
NPC1 O15118 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
SRD5A2 P31213 1/20 0.34
THRA P10827 1/20 0.34
TP53 P04637 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL2857757 0.93 SRD5A2 (0.39) ABCB1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL13604875 0.91 VDR (0.45) VDRPPARGPPARAMAPTNPC1
SCHEMBL2856305 0.90 PPARG (0.37) PPARGPPARAABCB1RAB9AMAPT
SCHEMBL1022002 0.84 MTNR1A (0.44) VDRPPARGPPARAMEN1KMT2A
SCHEMBL2863756 0.83 SRD5A2 (0.38) ABCB1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL2863404 0.80 VDR (0.68) VDRPPARGPPARARAB9AMAPT
SCHEMBL2863408 0.79 VDR (0.49) VDRPPARGPPARARAB9AMAPT
SCHEMBL1022007 0.78 ALDH1A1 (0.42) VDRPPARGPPARAALDH1A1HTT
SCHEMBL2858864 0.74 VDR (0.49) VDRPPARGPPARARAB9AMAPT
SCHEMBL2853381 0.72 VDR (0.58) VDRRAB9AMAPTNPC1SMN1; SMN2

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
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
EP-1456160-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2004-09-15 EP disclosed
US-20030195259-A1 Triaromatic vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT (FR) 2003-10-16 US disclosed
WO-2003050067-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, SNC (FR) 2003-06-19 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-20030195259-A1 Triaromatic vitamin D analogues CYP24A1, CYP2R1, VDR VDR 3/4885PPARG 96/4885PPARA 204/4885

“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.