SCHEMBL19855425

SCHEMBL19855425

C=CC(=O)N(C)CCCc1ccc2c(ccc3cc(CCCCC)ccc32)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 9/20 0.47
▸ THRA P10827 8/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ NCEH1 Q6PIU2 2/20 0.40
▸ SIGMAR1 Q99720 1/20 0.39
▸ KAT8 Q9H7Z6 2/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ PSMB5 P28074 1/20 0.38

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
SCHEMBL19855335 0.93 THRB (0.52) THRBTHRAMEN1KMT2ASIGMAR1
SCHEMBL19855942 0.87 THRB (0.50) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL23635452 0.87 THRB (0.48) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL19855420 0.86 THRB (0.60) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL19854038 0.83 THRB (0.55) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL19855908 0.83 THRB (0.55) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL19854073 0.83 THRB (0.55) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL19855022 0.82 THRB (0.43) THRBTHRAMEN1KMT2ASIGMAR1
SCHEMBL20370615 0.82 THRB (0.50) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL19853988 0.80 THRB (0.50) THRBTHRAMEN1KMT2AALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10662379-B2 Polymerizable polar compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2020-05-26 — — US disclosed
US-20180195005-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-07-12 — — US disclosed
US-20180195005-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-07-12 — — US disclosed
WO-2018025974-A1 LIQUID-CRYSTAL DISPLAY ELEMENT AND DISPLAY DEVICE JNC株式会社 2018-02-08 — — WO 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-20180195005-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE SP1, MBD2, PAXBP1 THRB 3939/4885THRA 3929/4885MEN1 73/4885
US-10662379-B2 Polymerizable polar compound, liquid crystal composition and liquid crystal display device SP1, MBD2, PAXBP1 THRB 3939/4885THRA 3929/4885MEN1 73/4885

“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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