SCHEMBL20111334

SCHEMBL20111334

C=CCCC1CCC(c2ccc(-c3ccc4c(c3F)-c3c-4cc(C)c(F)c3F)cc2)CC1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.34
SOAT1 P35610 2/20 0.34
ESR2 Q92731 2/20 0.33
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
FAAH O00519 1/20 0.30
CHRM2 P08172 1/20 0.30
DGAT2 Q96PD7 1/20 0.30
PDE10A Q9Y233 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
SCHEMBL4549714 0.87 DGAT1 (0.37) DGAT1SOAT1ESR2CYP3A4CYP2C9
SCHEMBL9970179 0.87 DGAT1 (0.37) DGAT1SOAT1ESR2CYP3A4CYP2C9
SCHEMBL20102579 0.86 MEN1 (0.33) DGAT1SOAT1ESR2CYP2C9MEN1
SCHEMBL20102481 0.84 OPRL1 (0.37)
SCHEMBL20102580 0.84 MEN1 (0.36) DGAT1SOAT1ESR2CYP3A4CYP2C9
SCHEMBL8933570 0.82 CYP3A4 (0.36) DGAT1SOAT1ESR2CYP3A4CYP2C9
SCHEMBL20906858 0.79 ESR2 (0.38) DGAT1SOAT1ESR2CYP3A4CYP2C9
SCHEMBL8959485 0.79 CYP3A4 (0.34) DGAT1SOAT1CYP3A4CYP2C9
SCHEMBL20111262 0.77 PDE10A (0.32) PDE10A
SCHEMBL10030938 0.77 DGAT1 (0.35) DGAT1SOAT1ESR2CYP3A4CYP2C9

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 DGAT1 2593/4885SOAT1 3042/4885ESR2 1639/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S DGAT1 2593/4885SOAT1 3042/4885ESR2 1639/4885

“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.