SCHEMBL18314879

SCHEMBL18314879

CCOc1ccc(-c2ccc(C(F)(F)Oc3cc(F)c(OC(F)(F)C=C(F)F)c(F)c3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.37
CYP1A1 P04798 2/20 0.34
CYP1B1 Q16678 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 1/20 0.34
ATM Q13315 1/20 0.34
MAOB P27338 1/20 0.34
FFAR1 O14842 2/20 0.33
PPARD Q03181 2/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
CHRNA7 P36544 2/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
MITF O75030 1/20 0.31

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
SCHEMBL18315057 0.86 MAOB (0.32) MAOB
SCHEMBL18315070 0.86 MAOB (0.32) MAOB
SCHEMBL18314997 0.83 PTGS2 (0.38) ERN1LMNAFFAR1PPARDFFAR4
SCHEMBL18314890 0.82 MAOB (0.35) MAOB
SCHEMBL18314918 0.82 THRB (0.32)
SCHEMBL18315082 0.81 S1PR1 (0.33)
SCHEMBL17050125 0.80 S1PR1 (0.34)
SCHEMBL18314827 0.80 MAOB (0.30) MAOB
SCHEMBL18315077 0.80 PTGS2 (0.36) ERN1FFAR1PPARDFFAR4TUBB4A
SCHEMBL18315000 0.79 ALDH1A1 (0.38) LMNAMAPTFFAR4MEN1ALDH1A1

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-20160362605-A1 LIQUID CRYSTAL COMPOUND HAVING 1,1,3,3-TETRAFLUOROALLYLOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2016-12-15 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-20160362605-A1 LIQUID CRYSTAL COMPOUND HAVING 1,1,3,3-TETRAFLUOROALLYLOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE TCOF1, PIEZO1, RCC1 ERN1 1553/4885CYP1A1 359/4885CYP1B1 381/4885

“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.