SCHEMBL12223313

SCHEMBL12223313

CC(O)c1ccc(-c2ccc(OCC3CCC(C4CCC(c5ccc(C6CO6)c(F)c5F)CC4)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 2/20 0.33
▸ FEN1 P39748 2/20 0.33
▸ CNR2 P34972 14/20 0.33
▸ CNR1 P21554 5/20 0.33
▸ PIM1 P11309 2/20 0.32
▸ FPR2 P25090 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
SCHEMBL12836034 0.97 FEN1 (0.34) ALOX5APFEN1CNR2CNR1PIM1
SCHEMBL12836492 0.97 FEN1 (0.34) ALOX5APFEN1CNR2CNR1PIM1
SCHEMBL12907337 0.93 CNR2 (0.35) ALOX5APFEN1CNR2CNR1FPR2
SCHEMBL12222857 0.91 CNR2 (0.34) ALOX5APFEN1CNR2FPR2
SCHEMBL11939324 0.88 CNR2 (0.37) ALOX5APFEN1CNR2CNR1
SCHEMBL11939352 0.88 CNR2 (0.37) ALOX5APFEN1CNR2CNR1
SCHEMBL12836054 0.88 CNR2 (0.36) ALOX5APFEN1CNR2FPR2
SCHEMBL12836512 0.88 CNR2 (0.36) ALOX5APFEN1CNR2FPR2
SCHEMBL12836499 0.88 FPR2 (0.33) CNR2PIM1FPR2
SCHEMBL12836501 0.88 FFAR4 (0.34) ALOX5APFEN1CNR2FPR2

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-20110240919-A1 FIVE-RING COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-10-06 — — 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-20110240919-A1 FIVE-RING COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE NCAPD3, CCND3, ZKSCAN2 ALOX5AP 1073/4885FEN1 3903/4885CNR2 253/4885

“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.

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