SCHEMBL12224043

SCHEMBL12224043

Oc1ccc(C2CCC(CCC3CCC(C4CCC(c5ccc(C6CO6)c(F)c5F)CC4)CC3)CC2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 16/20 0.32
ESR2 Q92731 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
SCHEMBL12223977 0.91 OPRL1 (0.32) OPRL1ESR2
SCHEMBL12223362 0.90 OPRL1 (0.36) OPRL1ESR2
SCHEMBL12223881 0.87 ALOX5AP (0.31)
SCHEMBL12223838 0.86 ALOX5AP (0.32) ESR2
SCHEMBL12223444 0.86 OPRL1 (0.33) OPRL1
SCHEMBL12223578 0.86 GPR119 (0.36)
SCHEMBL12224044 0.85
SCHEMBL3576039 0.84 CYP2C9 (0.36) OPRL1
SCHEMBL10051625 0.84 CYP2C9 (0.36) OPRL1
SCHEMBL3269921 0.82 CYP2C9 (0.40) OPRL1

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 OPRL1 1746/4885ESR2 2115/4885

“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.