SCHEMBL17356677

SCHEMBL17356677

CCCCCC1CCC(c2cc3ccc(-c4cc(F)c(F)c(F)c4)c(F)c3c(F)c2F)CC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.35
MAPT P10636 1/20 0.35
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
MAPK1 P28482 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
SCHEMBL17356666 0.88 GAA (0.38) GAAMAPTMEN1KMT2AMAPK1
SCHEMBL17356592 0.86 GAA (0.37) GAAMAPTMEN1KMT2AMAPK1
SCHEMBL17356688 0.85
SCHEMBL17356644 0.83 GAA (0.35) GAAMAPTMEN1KMT2A
SCHEMBL17356671 0.83 GAA (0.34) GAAMAPT
SCHEMBL17359301 0.81 ALOX5AP (0.31)
SCHEMBL17487896 0.81 RARB (0.31)
SCHEMBL8453242 0.80 GAA (0.37) GAAMAPTMEN1KMT2AMAPK1
SCHEMBL8453248 0.80 GAA (0.37) GAAMAPTMEN1KMT2AMAPK1
SCHEMBL17552979 0.80 OPRL1 (0.34) GAAMAPTMEN1KMT2AMAPK1

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-9527870-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-12-27 US disclosed
US-20150368272-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-12-24 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-20150368272-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE YBX3, OCIAD1, PIEZO1 GAA 4503/4885MAPT 1138/4885MEN1 2165/4885

“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.