SCHEMBL8932727

SCHEMBL8932727

CCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
FPR2 P25090 5/20 0.34
ALOX5AP P20292 3/20 0.33
FEN1 P39748 3/20 0.33
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ESR1 P03372 1/20 0.30
S1PR1 P21453 2/20 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
SCHEMBL8935034 0.99 GAA (0.36) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL8961943 0.97 GAA (0.33) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL8962135 0.96 GAA (0.34) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL8934960 0.94 FPR2 (0.34) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL8934964 0.94 GAA (0.34) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL11940757 0.94 GAA (0.36) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL1574427 0.94 FEN1 (0.35) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL12740820 0.94 FEN1 (0.35) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL8935040 0.93 GAA (0.35) GAAMAPTFPR2ALOX5APFEN1
SCHEMBL8935047 0.93 GAA (0.35) GAAMAPTFPR2ALOX5APFEN1

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-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

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 GAA 4800/4885MAPT 568/4885FPR2 1427/4885

“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.