SCHEMBL2855027

SCHEMBL2855027

CCCc1cc(C(=O)CC)ccc1-c1cc(O)ccc1C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
PPARG P37231 6/20 0.39
PPARA Q07869 6/20 0.39
HSP90AB1 P08238 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
HSD17B1 P14061 1/20 0.38
VDR P11473 1/20 0.37
HSD17B3 P37058 3/20 0.37
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ATM Q13315 1/20 0.35

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
SCHEMBL1022007 0.88 ALDH1A1 (0.42) HTTALDH1A1HPGDPPARGPPARA
SCHEMBL2854602 0.83 ALDH1A1 (0.39) HTTALDH1A1HPGDPPARGPPARA
SCHEMBL2858257 0.79 VDR (0.63) HTTALDH1A1HPGDPPARGPPARA
SCHEMBL2856601 0.79 ALDH1A1 (0.46) HTTALDH1A1HPGDHSP90AB1HSD17B1
SCHEMBL2856305 0.78 PPARG (0.37) HPGDPPARGPPARASMN1; SMN2
SCHEMBL2858262 0.78 VDR (0.43) HTTALDH1A1HPGDPPARGPPARA
SCHEMBL2860527 0.77 PPARG (0.35) HTTALDH1A1HPGDPPARGPPARA
SCHEMBL2860523 0.77 PPARG (0.35) HTTALDH1A1HPGDPPARGPPARA
SCHEMBL2863419 0.76 RAB9A (0.42) HTTALDH1A1HPGDPPARGPPARA
SCHEMBL2863416 0.76 VDR (0.58) HTTALDH1A1HPGDPPARGPPARA

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 HTT 2386/4885ALDH1A1 151/4885HPGD 85/4885

“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.