SCHEMBL8957254

SCHEMBL8957254

CCCCCCCC1OCC(c2ccc(-c3ccc(-c4ccc(CCCC)c(F)c4F)cc3)c(F)c2F)CO1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
ENPP2 Q13822 2/20 0.31
PRKD3 O94806 1/20 0.30
PRKCG P05129 1/20 0.30
PRKCB P05771 1/20 0.30
PRKCA P17252 1/20 0.30
PRKCH P24723 1/20 0.30
PRKCI P41743 1/20 0.30
PRKCE Q02156 1/20 0.30
PRKCQ Q04759 1/20 0.30
PRKCZ Q05513 1/20 0.30
PRKCD Q05655 1/20 0.30
PRKD1 Q15139 1/20 0.30

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
SCHEMBL8957155 0.99 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8957253 0.98 ENPP2 (0.33) ALDH1A1ENPP2PRKD3PRKCGPRKCB
SCHEMBL8957105 0.98 ENPP2 (0.33) ALDH1A1ENPP2PRKD3PRKCGPRKCB
SCHEMBL8957173 0.98 ENPP2 (0.33) ALDH1A1ENPP2PRKD3PRKCGPRKCB
SCHEMBL8957277 0.98 ENPP2 (0.33) ALDH1A1ENPP2PRKD3PRKCGPRKCB
SCHEMBL8957043 0.98 ENPP2 (0.33) ALDH1A1ENPP2PRKD3PRKCGPRKCB
SCHEMBL8957273 0.98 ENPP2 (0.33) ALDH1A1ENPP2PRKD3PRKCGPRKCB
SCHEMBL8957167 0.98 ENPP2 (0.33) ALDH1A1ENPP2PRKD3PRKCGPRKCB
SCHEMBL8957305 0.98 ENPP2 (0.33) ALDH1A1ENPP2PRKD3PRKCGPRKCB
SCHEMBL8957261 0.98 ENPP2 (0.33) ALDH1A1ENPP2PRKD3PRKCGPRKCB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed
US-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-09 US disclosed
EP-2206695-A1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT Chisso Corporation (JP) 2010-07-14 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-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE KIF23, HCN3, FZD7 ALDH1A1 3844/4885ENPP2 4062/4885PRKD3 190/4885

“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.