SCHEMBL20111307

SCHEMBL20111307

COc1cc2c(c(F)c1F)-c1c-2ccc(C2CCC(C)CC2)c1F

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 14/20 0.34
FEN1 P39748 14/20 0.34
FPR2 P25090 2/20 0.32
HTR7 P34969 1/20 0.31
CYP17A1 P05093 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
SCHEMBL20117893 0.84 ESR2 (0.32)
SCHEMBL20111510 0.84 ALOX5AP (0.32) ALOX5APFEN1HTR7CYP17A1
SCHEMBL20117669 0.84 SCN9A (0.43) ALOX5APFEN1
SCHEMBL20111308 0.84 ALDH1A1 (0.36) ALOX5APFEN1FPR2
SCHEMBL20111250 0.82 NOTUM (0.32)
SCHEMBL20111543 0.81 ESR2 (0.36) ALOX5APFEN1
SCHEMBL20117743 0.81
SCHEMBL10035142 0.80 ALOX5AP (0.36) ALOX5APFEN1FPR2
SCHEMBL16922997 0.80 ALOX5AP (0.36) ALOX5APFEN1FPR2
SCHEMBL170527 0.79 HTR2C (0.37) ALOX5APFEN1

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 3 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
EP-3315583-A1 LIQUID CRYSTAL COMPOUND HAVING BIPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2018-05-02 EP 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 ALOX5AP 2002/4885FEN1 1547/4885FPR2 869/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S ALOX5AP 2002/4885FEN1 1547/4885FPR2 869/4885

“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.