SCHEMBL12889584

SCHEMBL12889584

CCCCCc1ccc(CCC2CCC(c3ccc(OC)cc3F)CC2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.41
CNR1 P21554 2/20 0.41
HTR2A P28223 1/20 0.38
OPRL1 P41146 8/20 0.36
FFAR1 O14842 4/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL12716807 0.94 CNR1 (0.36) CNR2CNR1HTR2AOPRL1FFAR1
SCHEMBL10302109 0.90 CNR2 (0.39) CNR2CNR1OPRL1
SCHEMBL10302106 0.90 FFAR1 (0.38) OPRL1FFAR1MEN1POLBHTT
SCHEMBL12735185 0.89 HTR2A (0.39) CNR2CNR1HTR2AL3MBTL1
SCHEMBL12739755 0.88 MEN1 (0.37) CNR2CNR1HTR2AFFAR1MEN1
SCHEMBL12716808 0.88 OPRL1 (0.37) OPRL1FFAR1MEN1POLBHTT
SCHEMBL12889860 0.87 CNR2 (0.42) CNR2CNR1HTR2AFFAR1MEN1
SCHEMBL10303071 0.87 OPRL1 (0.37) OPRL1FFAR1MEN1POLBHTT
SCHEMBL10302112 0.87 FFAR1 (0.38) OPRL1FFAR1MEN1POLBHTT
SCHEMBL19722481 0.86 OPRL1 (0.41) HTR2AOPRL1FFAR1

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-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-02-17 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-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, L3MBTL3 CNR2 2145/4885CNR1 1338/4885HTR2A 1823/4885

“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.