SCHEMBL8934309

SCHEMBL8934309

CCCCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(OC)c(F)c4F)cc3)cc2F)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.36
NAAA Q02083 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
DGAT1 O75907 1/20 0.35
OPRL1 P41146 6/20 0.34
CNR2 P34972 3/20 0.34
CNR1 P21554 2/20 0.34
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
TDP2 O95551 1/20 0.33
FPR2 P25090 1/20 0.33

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
SCHEMBL8934025 0.99 NAAA (0.36) MGLLNAAAGRIN1GRIN2BDGAT1
SCHEMBL8960823 0.97 MGLL (0.35) MGLLNAAAGRIN1GRIN2BDGAT1
SCHEMBL8960707 0.96 NAAA (0.34) MGLLNAAAGRIN1GRIN2BDGAT1
SCHEMBL8934342 0.92 OPRL1 (0.34) NAAAGRIN1GRIN2BDGAT1OPRL1
SCHEMBL8934063 0.92 NAAA (0.37) NAAAGRIN1GRIN2BDGAT1OPRL1
SCHEMBL8934291 0.91 PTPN11 (0.35) DGAT1OPRL1GAAMAPTFPR2
SCHEMBL8934028 0.91 PTPN11 (0.35) DGAT1OPRL1GAAMAPTFPR2
SCHEMBL8934039 0.91 PTPN11 (0.35) DGAT1OPRL1GAAMAPTFPR2
SCHEMBL8934153 0.91 PTPN11 (0.35) DGAT1OPRL1GAAMAPTFPR2
SCHEMBL8934130 0.91 PTPN11 (0.35) DGAT1OPRL1GAAMAPTFPR2

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 MGLL 2808/4885NAAA 4128/4885GRIN1 3087/4885

“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.