SCHEMBL13994292

SCHEMBL13994292

C=C(c1ccc(C(CC)(CC)c2ccc(OCC(O)C(C)(C)C)c(CC)c2)o1)N(C)OC

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
VDR P11473 12/20 0.42
AR P10275 4/20 0.42
HDAC6 Q9UBN7 7/20 0.41
HDAC3 O15379 3/20 0.41
HDAC1 Q13547 1/20 0.41

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
SCHEMBL4630933 0.85 HDAC6 (0.46) VDRARHDAC6HDAC3HDAC1
SCHEMBL14199588 0.84 HDAC6 (0.48) VDRARHDAC6HDAC3HDAC1
SCHEMBL4631752 0.79 HDAC6 (0.45) VDRARHDAC6HDAC3HDAC1
SCHEMBL4632569 0.76 HDAC6 (0.57) VDRARHDAC6HDAC3HDAC1
SCHEMBL14199184 0.74 HDAC6 (0.45) VDRARHDAC6HDAC3HDAC1
SCHEMBL13714045 0.69 VDR (0.51) VDRARHDAC6HDAC3HDAC1
SCHEMBL2978950 0.68 HDAC6 (0.61) VDRARHDAC6HDAC3HDAC1
SCHEMBL14199410 0.68 HDAC6 (0.44) VDRARHDAC6HDAC3HDAC1
SCHEMBL6437088 0.68 HDAC6 (0.53) VDRARHDAC6HDAC3HDAC1
SCHEMBL3422595 0.67 HDAC6 (0.51) VDRARHDAC6HDAC3HDAC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7468449-B2 Phenyl-furan compounds as vitamin D receptor modulators ELI LILLY AND COMPANY (US) 2008-12-23 US disclosed
US-20070105951-A1 Phenyl-furan compounds as vitamin d receptor modulators ELI LILLY AND COMPANY 2007-05-10 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-20070105951-A1 Phenyl-furan compounds as vitamin d receptor modulators VDR, CYP24A1, CYP2R1 VDR 1/4885AR 509/4885HDAC6 4563/4885

“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.