SCHEMBL18324939

SCHEMBL18324939

Cc1ccc(-c2cc(F)c(C(F)(F)Oc3cc(F)c(OC(F)(F)F)c(F)c3)c(F)c2)cc1C

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
FFAR4 Q5NUL3 2/20 0.32
CYP11B1 P15538 2/20 0.31
CYP11B2 P19099 2/20 0.31
FFAR1 O14842 1/20 0.31
IDH1 O75874 1/20 0.30
PTGS2 P35354 1/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30
SCN5A Q14524 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
SCHEMBL18324925 0.95 KDM4E (0.32) KDM4EGAAMAPTMAPK1PTGS2
SCHEMBL18324922 0.93 ALOX5AP (0.37) KDM4EGAAMAPTMAPK1FFAR4
SCHEMBL18324928 0.89 CYP11B1 (0.33) KDM4EGAAMAPTMAPK1CYP11B1
SCHEMBL18324919 0.88 PTGS2 (0.34) KDM4EGAAMAPTMAPK1CYP11B1
SCHEMBL18324927 0.88 CYP11B1 (0.35) KDM4EGAAMAPTMAPK1CYP11B1
SCHEMBL10018743 0.86 CYP11B1 (0.32) MAPTFFAR4CYP11B1CYP11B2FFAR1
SCHEMBL18324930 0.86 PTGS2 (0.33) KDM4EGAAMAPTMAPK1CYP11B1
SCHEMBL18324945 0.85 AKR1C3 (0.35) CYP11B1CYP11B2PTGS2ALOX5APFEN1
SCHEMBL18324929 0.84 PTGS2 (0.32) CYP11B1CYP11B2PTGS2
SCHEMBL18324935 0.83 PTGS2 (0.34) PTGS2

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-9862886-B2 Compound, liquid crystal composition including the same, and liquid crystal display device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-09 US disclosed
US-20160369167-A1 COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME, AND LIQUID CRYSTAL DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-12-22 US disclosed
US-20160369167-A1 COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME, AND LIQUID CRYSTAL DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-12-22 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-20160369167-A1 COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME, AND LIQUID CRYSTAL DISPLAY DEVICE INCLUDING THE SAME SCO2, NCAPD3, OCIAD2 KDM4E 3368/4885GAA 4858/4885MAPT 3462/4885

“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.