SCHEMBL12223321

SCHEMBL12223321

CCCC(O)c1ccc(C2CCC(OCC3CCC(c4ccc(-c5ccc(OCC)c(F)c5F)c(F)c4F)CC3)CC2)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 5/20 0.34
▸ ALOX5AP P20292 1/20 0.32
▸ FEN1 P39748 1/20 0.32
▸ ACACB O00763 2/20 0.31
▸ CNR2 P34972 4/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ SCN9A Q15858 1/20 0.31
▸ HCRTR2 O43614 2/20 0.30
▸ FPR2 P25090 1/20 0.30
▸ PTGDR2 Q9Y5Y4 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
SCHEMBL12223510 1.00 GPR119 (0.34) GPR119ALOX5APFEN1ACACBCNR2
SCHEMBL12224684 0.93 GPR119 (0.36) GPR119ACACBCNR2SCN9AHCRTR2
SCHEMBL12224680 0.93 GPR119 (0.36) GPR119ACACBCNR2SCN9AHCRTR2
SCHEMBL11939325 0.93 CNR2 (0.36) ALOX5APFEN1CNR2CNR1SCN9A
SCHEMBL11939353 0.93 CNR2 (0.36) ALOX5APFEN1CNR2CNR1SCN9A
SCHEMBL11939128 0.91 FPR2 (0.34) ALOX5APFEN1ACACBFPR2
SCHEMBL12223996 0.90 GPR119 (0.34) GPR119ALOX5APFEN1ACACBHCRTR2
SCHEMBL12223906 0.90 CNR2 (0.34) ALOX5APFEN1CNR2CNR1SCN9A
SCHEMBL12224646 0.90 GPR119 (0.34) GPR119ALOX5APFEN1ACACBHCRTR2
SCHEMBL12223307 0.90 FPR2 (0.32) 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 GPR119 4269/4885ALOX5AP 1073/4885FEN1 3903/4885

“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.

Send feedback