SCHEMBL20380685

SCHEMBL20380685

CC1CCC(C(F)(F)Oc2ccc(-c3ccc(-c4ccc(F)c(F)c4)c(F)c3F)cc2)CC1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.33
CYP2C9 P11712 1/20 0.33
GRM2 Q14416 1/20 0.33
P2RY1 P47900 1/20 0.33
FFAR4 Q5NUL3 2/20 0.32
CHEK1 O14757 1/20 0.32
MMP12 P39900 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
TRPA1 O75762 1/20 0.31
KDM1A O60341 1/20 0.30
CREBBP Q92793 1/20 0.30
STAT3 P40763 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
SCHEMBL20380617 0.91 APP (0.33) APPCYP2C9GRM2FFAR4CHEK1
SCHEMBL16325783 0.90 APP (0.37) APPCYP2C9GRM2P2RY1FFAR4
SCHEMBL16326155 0.90 ALOX5AP (0.35) APPCYP2C9GRM2P2RY1FFAR4
SCHEMBL12889493 0.89 ALOX5AP (0.40) APPCYP2C9GRM2P2RY1FFAR4
SCHEMBL12889466 0.89 MMP12 (0.36) GRM2FFAR4CHEK1MMP12TRPA1
SCHEMBL16325794 0.87 ALOX5AP (0.33) APPCYP2C9GRM2P2RY1CHEK1
SCHEMBL17365955 0.86 MMP12 (0.31) APPCYP2C9GRM2FFAR4MMP12
SCHEMBL20380742 0.86 APP (0.32) APPCYP2C9GRM2ALOX5APFEN1
SCHEMBL16325978 0.86 ALOX5AP (0.38) APPCYP2C9GRM2P2RY1FFAR4
SCHEMBL16325929 0.85 MMP12 (0.35) FFAR4MMP12TRPA1

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 1 patent. 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

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-10023799-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device PIEZO1, ROCK1, RCC1 APP 1099/4885CYP2C9 756/4885GRM2 3312/4885

“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.