SCHEMBL18324935

SCHEMBL18324935

Cc1ccc(-c2cc(F)c(-c3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3)c(F)c2)cc1C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.34
PTGS1 P23219 1/20 0.33
NISCH Q9Y2I1 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
SCHEMBL18324919 0.95 PTGS2 (0.34) PTGS2PTGS1NISCH
SCHEMBL18324929 0.94 PTGS2 (0.32) PTGS2PTGS1NISCH
SCHEMBL18324930 0.93 PTGS2 (0.33) PTGS2PTGS1
SCHEMBL18324925 0.89 KDM4E (0.32) PTGS2
SCHEMBL15603972 0.88 CYP11B1 (0.32)
SCHEMBL18324928 0.88 CYP11B1 (0.33) PTGS2PTGS1NISCH
SCHEMBL18324924 0.87 AKR1C3 (0.37) PTGS2PTGS1
SCHEMBL18324927 0.87 CYP11B1 (0.35) PTGS2PTGS1
SCHEMBL21374095 0.85 PTGS2 (0.36) PTGS2PTGS1
SCHEMBL12889566 0.84

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 PTGS2 4053/4885PTGS1 4355/4885NISCH 989/4885

“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.