SCHEMBL13264597

SCHEMBL13264597

Fc1c(OCC2CCC(C3CCC(C4CCC(C(F)(F)F)CC4)CC3)CC2)ccc(C2CO2)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 6/20 0.38
▸ HTR2C P28335 5/20 0.34
▸ HTR2B P41595 4/20 0.34
▸ HTR2A P28223 3/20 0.34
▸ LRRK2 Q5S007 1/20 0.30

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
SCHEMBL13264398 0.87 HTR2C (0.34) HTR2CHTR2BHTR2A
SCHEMBL13762035 0.86 HTR2C (0.36) HTR2CHTR2BHTR2A
SCHEMBL13762037 0.86 HPGD (0.38) SCN9AHTR2CHTR2BHTR2A
SCHEMBL13762038 0.85 HTR2C (0.33) HTR2CHTR2BHTR2A
SCHEMBL13235554 0.81 SCN9A (0.41) SCN9AHTR2CHTR2BHTR2ALRRK2
SCHEMBL13264595 0.78 HTR2C (0.34) HTR2CHTR2BHTR2A
SCHEMBL13264596 0.77 HPGD (0.40) SCN9AHTR2CHTR2BHTR2A
SCHEMBL9920720 0.76 HTR2C (0.36) HTR2CHTR2BHTR2A
SCHEMBL13762091 0.76 HTR2C (0.34) HTR2CHTR2BHTR2A
SCHEMBL12388763 0.75 HTR2C (0.38) HTR2CHTR2BHTR2A

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-7758931-B2 Chlorofluorobenzene liquid crystal compound, liquid crystal composition, and liquid crystal display device CHISSO CORPORATION (JP) 2010-07-20 — — US disclosed
US-20090264683-A1 CHLOROFLUOROBENZENE LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2009-10-22 — — 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-20090264683-A1 CHLOROFLUOROBENZENE LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CCND3, CCND1, SLFN12 SCN9A 1801/4885HTR2C 663/4885HTR2B 455/4885

“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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