SCHEMBL20111308

SCHEMBL20111308

CCCC1CCC(c2ccc3c(c2F)-c2c-3cc(OC)c(F)c2F)CC1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
HTT P42858 1/20 0.36
OPRL1 P41146 12/20 0.35
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
FPR2 P25090 2/20 0.33
CYP2C9 P11712 1/20 0.32
DRD2 P14416 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
LMNA P02545 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
SCHEMBL20102395 0.91 MEN1 (0.33) ALDH1A1MAPTOPRL1MEN1MAPK1
SCHEMBL20102419 0.86 ALDH1A1 (0.38) ALDH1A1MAPTHTTOPRL1MEN1
SCHEMBL20111364 0.85 ALOX5AP (0.39) OPRL1ALOX5APFEN1
SCHEMBL20117671 0.85 SCN9A (0.39) ALOX5APFEN1
SCHEMBL20102486 0.84 OPRL1 (0.39) ALDH1A1MAPTOPRL1MEN1MAPK1
SCHEMBL20102565 0.84 ALOX5AP (0.33) ALOX5APFEN1
SCHEMBL20111307 0.84 ALOX5AP (0.34) FPR2ALOX5APFEN1
SCHEMBL20102476 0.83 CYP2C9 (0.36) ALDH1A1MAPTOPRL1MEN1MAPK1
SCHEMBL20111486 0.83 MEN1 (0.37) ALDH1A1MAPTOPRL1MEN1MAPK1
SCHEMBL19985477 0.83 ALDH1A1 (0.38) ALDH1A1MAPTHTTOPRL1MEN1

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 ALDH1A1 1182/4885MAPT 952/4885HTT 2921/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S ALDH1A1 1182/4885MAPT 952/4885HTT 2921/4885

“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.