SCHEMBL17367997

SCHEMBL17367997

CCCc1ccc(-c2ccc(-c3ccc(OC(F)(F)c4cc(F)c(F)c(F)c4)c(F)c3)cc2)c(Cl)c1F

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.31
GRM2 Q14416 1/20 0.31
CTSL P07711 1/20 0.31
CTSS P25774 1/20 0.31
NAAA Q02083 1/20 0.31
PTGS2 P35354 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
SCHEMBL17367989 0.90 CTSK (0.37) CTSKCTSLCTSSNAAAPTGS2
SCHEMBL17367991 0.84 CTSK (0.37) CTSKCTSLCTSSNAAA
SCHEMBL17367980 0.84 CTSL (0.30) CTSKCTSLCTSS
SCHEMBL17367993 0.83 CTSK (0.35) CTSKCTSLCTSSNAAAPTGS2
SCHEMBL17365868 0.82 KIF11 (0.33)
SCHEMBL17367999 0.80 FFAR4 (0.35) CTSKCTSLCTSSNAAA
SCHEMBL17368000 0.80 CTSL (0.34) CTSKCTSLCTSS
SCHEMBL17368009 0.80 CTSK (0.35) CTSKCTSLCTSSNAAA
SCHEMBL17367990 0.79 CTSL (0.34) CTSKCTSLCTSS
SCHEMBL17367995 0.78 CTSK (0.32) CTSKNAAA

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-10023799-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2018-07-17 US disclosed
US-20150376504-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-12-31 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 (2 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-10023799-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device PIEZO1, ROCK1, RCC1 CTSK 1913/4885GRM2 3312/4885CTSL 2885/4885
US-20150376504-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE PIEZO1, ROCK1, RCC1 CTSK 1913/4885GRM2 3312/4885CTSL 2885/4885

“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.