SCHEMBL12223836

SCHEMBL12223836

CCOc1ccc(C2CCC(C3CCC(c4ccc(-c5ccc(C(O)CC)c(F)c5F)c(F)c4F)CC3)CC2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 3/20 0.34
▸ PTGS1 P23219 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ ALOX5AP P20292 2/20 0.31
▸ FEN1 P39748 2/20 0.31
▸ PDE2A O00408 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
SCHEMBL11939218 0.96 FPR2 (0.35) FPR2PTGS1PTGS2ALOX5APFEN1
SCHEMBL12223288 0.91 FPR2 (0.33) FPR2ALOX5APFEN1
SCHEMBL11939167 0.90 CNR2 (0.39) ALOX5APFEN1
SCHEMBL11939058 0.90 CNR2 (0.39) ALOX5APFEN1
SCHEMBL12223936 0.90 FPR2 (0.34) FPR2PTGS1PTGS2ALOX5APFEN1
SCHEMBL12223286 0.89 — —
SCHEMBL14922522 0.88 FPR2 (0.37) FPR2ALOX5APFEN1
SCHEMBL11939822 0.87 NAAA (0.33) FPR2ALOX5APFEN1
SCHEMBL11939128 0.87 FPR2 (0.34) FPR2ALOX5APFEN1
SCHEMBL12222857 0.87 CNR2 (0.34) FPR2ALOX5APFEN1

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 FPR2 1970/4885PTGS1 3674/4885PTGS2 3091/4885

“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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