SCHEMBL5569766

SCHEMBL5569766

Cc1cc(CCCc2ccc(CO)c(CO)c2)ccc1O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.52
ESR2 Q92731 2/20 0.52
IGF1R P08069 5/20 0.45
ALOX15 P16050 5/20 0.45
SHBG P04278 1/20 0.43
SLC28A3 Q9HAS3 1/20 0.42
CYP19A1 P11511 1/20 0.42
BACE1 P56817 2/20 0.40
VDR P11473 1/20 0.40
BCHE P06276 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX5 P09917 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
TP53 P04637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL529618 0.86 ESR1 (0.68) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL5569437 0.83 BACE1 (0.60) ESR1ESR2IGF1RALOX15CYP19A1
SCHEMBL68664 0.82 ESR1 (0.68) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL2913327 0.80 ESR1 (0.61) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL12949979 0.80 ESR1 (0.65) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL16065724 0.80 ESR1 (0.65) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL6227927 0.80 ESR1 (0.65) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL8402779 0.80 ESR1 (0.65) ESR1ESR2IGF1RALOX15SLC28A3
SCHEMBL28999062 0.79 SLC28A3 (0.67) ESR1ESR2IGF1RALOX15SHBG
SCHEMBL10388452 0.79 ESR1 (0.59) ESR1ESR2IGF1RALOX15SLC28A3

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 ESR1 1406/4885ESR2 851/4885IGF1R 1383/4885

“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.