SCHEMBL8970707

SCHEMBL8970707

CCOc1ccc(-c2ccc(-c3ccc(COC4CCC(CC)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 5/20 0.42
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
FGFR2 P21802 2/20 0.34
FGFR1 P11362 1/20 0.34
RET P07949 1/20 0.33
ESR1 P03372 1/20 0.33
HTR1A P08908 1/20 0.32
FFAR4 Q5NUL3 1/20 0.31
CHKA P35790 1/20 0.31
ACACB O00763 1/20 0.31
FPR2 P25090 1/20 0.31
KDM1A O60341 2/20 0.30
PTPRC P08575 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
SCHEMBL8969206 0.85 FFAR4 (0.35) NAAAGRIN1GRIN2BFGFR2FGFR1
SCHEMBL12736592 0.84 NAAA (0.37) NAAAHTR1AACACB
SCHEMBL12740203 0.84 NAAA (0.37) NAAAHTR1AACACB
SCHEMBL12736885 0.82 FFAR4 (0.38) NAAAGRIN1GRIN2BFGFR2FGFR1
SCHEMBL12740386 0.82 FFAR4 (0.38) NAAAGRIN1GRIN2BFGFR2FGFR1
SCHEMBL12740309 0.82 NAAA (0.38) NAAAFGFR2FGFR1RETESR1
SCHEMBL14765827 0.82 NAAA (0.38) NAAAFGFR2FGFR1RETESR1
SCHEMBL12736734 0.82 NAAA (0.38) NAAAFGFR2FGFR1RETESR1
SCHEMBL14766585 0.82 NAAA (0.38) NAAAFGFR2FGFR1RETESR1
SCHEMBL9019928 0.81 HTR1A (0.34) HTR1A

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-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 NAAA 4128/4885GRIN1 3087/4885GRIN2B 2825/4885

“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.