SCHEMBL13709334

SCHEMBL13709334

CCC(CC)(c1ccc(CCC2(O)CCCCC2)c(C)c1)c1ccc(C(=O)N(C)C(C)C(=O)O)c(C)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
USP19 O94966 1/20 0.31

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
SCHEMBL13709286 0.99 HDAC3 (0.33) HDAC3HDAC6USP19
SCHEMBL13709337 0.87 NPC1 (0.32) USP19
SCHEMBL13709287 0.85 USP19 (0.32) USP19
SCHEMBL13709322 0.85
SCHEMBL13709319 0.85 VDR (0.35) HDAC3HDAC6
SCHEMBL13709292 0.84 VDR (0.30)
SCHEMBL13709332 0.84 HDAC3 (0.33) HDAC3HDAC6
SCHEMBL13709284 0.84 VDR (0.36) HDAC3HDAC6
SCHEMBL13709283 0.83 HDAC3 (0.33) HDAC3HDAC6
SCHEMBL13709338 0.83 VDR (0.32)

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-7595345-B2 Vitamin D receptor modulators ELI LILLY AND COMPANY (US) 2009-09-29 US disclosed
US-7595345-B2 Vitamin D receptor modulators ELI LILLY AND COMPANY (US) 2009-09-29 US disclosed
US-20080200552-A1 Vitamin D Receptor Modulators ELI LILLY AND COMPANY (IN) 2008-08-21 US disclosed
US-20080200552-A1 Vitamin D Receptor Modulators ELI LILLY AND COMPANY (IN) 2008-08-21 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-20080200552-A1 Vitamin D Receptor Modulators VDR, CYP2R1, CYP24A1 HDAC3 1756/4885HDAC6 4464/4885USP19 2484/4885

“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.