SCHEMBL20111422

SCHEMBL20111422

FC(F)=CCCc1ccc2c(c1F)-c1c-2cc(OCC2CCCCC2)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.33
PDK2 Q15119 2/20 0.32
C5AR1 P21730 1/20 0.32
HPGD P15428 2/20 0.31
FEN1 P39748 2/20 0.31
ALOX5AP P20292 1/20 0.31
PTGER1 P34995 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
SCN9A Q15858 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
SCHEMBL20117650 0.90 HPGD (0.33) HPGDSCN9A
SCHEMBL20102460 0.86
SCHEMBL20111291 0.84 CTSL (0.35) PARP10PDK2C5AR1FEN1ALOX5AP
SCHEMBL20111296 0.75 CYP19A1 (0.32) PARP10SCN9A
SCHEMBL20102467 0.75 PTGDR2 (0.37) C5AR1HPGD
SCHEMBL20111301 0.73
SCHEMBL20111289 0.73 SLC6A4 (0.35) PARP10PDK2C5AR1HPGDFEN1
SCHEMBL20102412 0.72
SCHEMBL20111654 0.72 BRD4 (0.33)
SCHEMBL20102457 0.72 CTSL (0.33)

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 PARP10 1825/4885PDK2 2502/4885C5AR1 343/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S PARP10 1825/4885PDK2 2502/4885C5AR1 343/4885

“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.