SCHEMBL20111370

SCHEMBL20111370

C=CC1CCC(C2CCC(COc3ccc4c(c3F)-c3c-4cc(O)c(F)c3F)CC2)CC1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.31
HTR2C P28335 3/20 0.31
HTR2B P41595 2/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 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
SCHEMBL20102587 0.87 PDE10A (0.32) HTR2AHTR2CHTR2BPDE4B
SCHEMBL20111371 0.86 HTR2A (0.31) HTR2AHTR2CHTR2B
SCHEMBL20111716 0.86 SCN9A (0.36) HTR2AHTR2CHTR2BPDE4APDE4B
SCHEMBL2266297 0.84 PDE4A (0.34) HTR2AHTR2CHTR2BPDE4APDE4B
SCHEMBL2266312 0.84 PDE4A (0.34) HTR2AHTR2CHTR2BPDE4APDE4B
SCHEMBL2266307 0.84 PDE4A (0.34) HTR2AHTR2CHTR2BPDE4APDE4B
SCHEMBL2266302 0.84 PDE4A (0.34) HTR2AHTR2CHTR2BPDE4APDE4B
SCHEMBL20111546 0.84 PDE4A (0.33) HTR2AHTR2CHTR2BPDE4APDE4B
SCHEMBL20111715 0.82 HPGD (0.35) HTR2AHTR2CHTR2B
SCHEMBL24170300 0.81 HTR2C (0.37) HTR2AHTR2CHTR2BPDE4APDE4B

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.