SCHEMBL20111311

SCHEMBL20111311

CC1CCC(COc2ccc3c(c2F)-c2c-3cc(O)c(F)c2F)CO1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.34
HTR2C P28335 3/20 0.34
HTR2B P41595 2/20 0.32
GRM2 Q14416 2/20 0.31
SLC6A9 P48067 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
SCHEMBL20117670 0.89 GRM2 (0.33) HTR2AHTR2CHTR2BGRM2
SCHEMBL20117614 0.87 FGFR2 (0.32) HTR2AHTR2CHTR2BGRM2
SCHEMBL20111359 0.86 HTR2A (0.31) HTR2AHTR2C
SCHEMBL20111705 0.84 HTR2A (0.30) HTR2AHTR2CHTR2B
SCHEMBL20111716 0.82 SCN9A (0.36) HTR2AHTR2CHTR2BSLC6A9
SCHEMBL20111269 0.81 HTR2A (0.33) HTR2AHTR2CHTR2BSLC6A9
SCHEMBL20111546 0.78 PDE4A (0.33) HTR2AHTR2CHTR2BSLC6A9
SCHEMBL20117659 0.76 FGFR2 (0.30)
SCHEMBL20111370 0.75 HTR2A (0.31) HTR2AHTR2CHTR2B
SCHEMBL20111355 0.75

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-06-18 US disclosed
US-20180119009-A1 LIQUID CRYSTAL COMPOUND HAVING BIPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-05-03 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 (2 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-20180119009-A1 LIQUID CRYSTAL COMPOUND HAVING BIPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE YBX1, PIEZO1, C1S HTR2A 791/4885HTR2C 134/4885HTR2B 651/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S HTR2A 791/4885HTR2C 134/4885HTR2B 651/4885

“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.