SCHEMBL13214256

SCHEMBL13214256

CC(=O)O[C@H]1CC[C@@]2(C)C(CCC3[C@@H]4CC[C@H]([C@H](C)CCCC(C)C)[C@@]4(C)CC[C@@H]32)C1

nearest known ligand 0.79

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
VDR P11473 3/20 0.79
USP2 O75604 1/20 0.79
CDC25A P30304 4/20 0.77
POLA1 P09884 1/20 0.76
CYP2D6 P10635 1/20 0.66
CYP2C19 P33261 1/20 0.66
INPP5D Q92835 1/20 0.65
ST6GAL1 P15907 1/20 0.61
FOLH1 Q04609 1/20 0.60
ABCC4 O15439 1/20 0.59

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
SCHEMBL19232373 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL4739364 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL15372968 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL11371121 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL4739362 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL106015 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL24403430 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL10052613 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL12205280 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6
SCHEMBL15289783 1.00 VDR (0.79) VDRUSP2CDC25APOLA1CYP2D6

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-7785675-B2 Compound and liquid crystal composition ADEKA CORPORATION (JP) 2010-08-31 US disclosed
US-7618554-B2 for in-plane switching (IPS) liquid crystal displays and low voltage-driven twist nematic (TN) liquid crystal displays and has a high dielectric anisotropy and a low rotational viscosity; perfluoroallyl difluorophenyl ethers ADEKA CORPORATION (JP) 2009-11-17 US disclosed
US-20090103041-A1 Novel compound and liquid crystal composition ADEKA CORPORATION (JP) 2009-04-23 US disclosed
US-20080149890-A1 Liquid Crystal Composition ADEKA CORPORATION (JP) 2008-06-26 US disclosed
EP-1840185-A1 LIQUID CRYSTAL COMPOSITION Adeka Corporation (JP) 2007-10-03 EP 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-20090103041-A1 Novel compound and liquid crystal composition PYM1, H1-0, H1-2 VDR 2126/4885USP2 3375/4885CDC25A 324/4885

“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.