SCHEMBL12822967

SCHEMBL12822967

CCC1CCC(c2ccc(OCC3CCC(c4ccc(C5CO5)c(F)c4F)CC3)c(F)c2F)CC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 14/20 0.39
▸ HTR2A P28223 2/20 0.37
▸ HTR2C P28335 2/20 0.37
▸ HTR2B P41595 2/20 0.37
▸ FPR2 P25090 1/20 0.35
▸ CNR1 P21554 2/20 0.34
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ SCN9A Q15858 1/20 0.33

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
SCHEMBL13586359 1.00 CNR2 (0.39) CNR2HTR2AHTR2CHTR2BFPR2
SCHEMBL12388763 0.91 HTR2C (0.38) CNR2HTR2AHTR2CHTR2BFPR2
SCHEMBL13586282 0.91 CNR2 (0.36) CNR2HTR2AHTR2CHTR2BFPR2
SCHEMBL12821510 0.91 CNR2 (0.36) CNR2HTR2AHTR2CHTR2BFPR2
SCHEMBL13654119 0.90 FPR2 (0.41) CNR2HTR2AHTR2CHTR2BFPR2
SCHEMBL12822744 0.89 CNR2 (0.37) CNR2HTR2AHTR2CHTR2BFPR2
SCHEMBL13586230 0.89 FPR2 (0.36) CNR2HTR2AHTR2CHTR2BFPR2
SCHEMBL12735766 0.89 CNR2 (0.38) CNR2HTR2AHTR2CHTR2BCNR1
SCHEMBL12740618 0.89 CNR2 (0.38) CNR2HTR2AHTR2CHTR2BCNR1
SCHEMBL13586463 0.88 CNR2 (0.37) CNR2HTR2AHTR2CHTR2BFPR2

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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 — — 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 CNR2 686/4885HTR2A 841/4885HTR2C 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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