SCHEMBL5565985

SCHEMBL5565985

CCC(/C=C/c1ccc(CO)c(CO)c1)(CC)c1ccc(CCC(O)C(C)(C)C)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.35
HDAC6 Q9UBN7 1/20 0.35
VDR P11473 13/20 0.34
AR P10275 4/20 0.32

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
SCHEMBL5565990 1.00 HDAC3 (0.35) HDAC3HDAC6VDRAR
SCHEMBL5565010 0.91 VDR (0.32) HDAC3VDR
SCHEMBL5565008 0.91 VDR (0.32) HDAC3VDR
SCHEMBL5565165 0.89 VDR (0.32) VDR
SCHEMBL5565162 0.89 VDR (0.32) VDR
SCHEMBL5564919 0.82 VDR (0.33) VDRAR
SCHEMBL5564915 0.82 VDR (0.33) VDRAR
SCHEMBL5569220 0.80 VDR (0.32) VDR
SCHEMBL5569214 0.80 VDR (0.32) VDR
SCHEMBL5569100 0.80 PGR (0.40) AR

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 4 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 claimed
US-20050182144-A1 Novel vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-08-18 US claimed
US-7312249-B2 Vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-12-25 US disclosed
US-20050182144-A1 Novel vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-08-18 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-20050182144-A1 Novel vitamin D analogues CYP24A1, CYP2R1, VDR HDAC3 2976/4885HDAC6 3568/4885VDR 3/4885

“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.