SCHEMBL8950667

SCHEMBL8950667

C=CC1COC(c2ccc(-c3ccc(-c4ccc(OC)c(F)c4F)cc3)cc2F)OC1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 1/20 0.35
FPR2 P25090 3/20 0.33
NAAA Q02083 2/20 0.33
HTR2C P28335 3/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
PTGS2 P35354 5/20 0.32
PTGS1 P23219 2/20 0.32
CYP17A1 P05093 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
ERN1 O75460 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
SCHEMBL8952150 0.90 FPR2 (0.33) FPR2
SCHEMBL8950736 0.90 FPR2 (0.33) FPR2NAAA
SCHEMBL8950861 0.88 TDP2 (0.34) TDP2FPR2NAAAHTR2CMEN1
SCHEMBL8950704 0.88 HTR2C (0.35) HTR2C
SCHEMBL8950637 0.87 GABRA1 (0.36) FPR2HTR2C
SCHEMBL8951139 0.87 GRIN1 (0.33) TDP2FPR2NAAAHTR2CMEN1
SCHEMBL12999750 0.87
SCHEMBL8941724 0.87 NAAA (0.33) TDP2FPR2NAAAHTR2CMEN1
SCHEMBL8950661 0.86 CNR2 (0.35) FPR2
SCHEMBL8950517 0.86

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 TDP2 3352/4885FPR2 1427/4885NAAA 4128/4885

“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.