SCHEMBL21074590

SCHEMBL21074590

C=C(CO)C(=O)Oc1ccc(C2(c3ccc(OC(=O)C(=C)CO)c(CC)c3)CCC(CCC3CCC(CCCCC)CC3)CC2)cc1CC

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 2/20 0.32
▸ ACHE P22303 1/20 0.30
▸ PPARG P37231 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ PPARA Q07869 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
SCHEMBL21074683 0.93 — —
SCHEMBL21074612 0.92 — —
SCHEMBL21074602 0.89 CYP2C9 (0.34) —
SCHEMBL21074588 0.86 LSS (0.34) HPGD
SCHEMBL21074682 0.86 — —
SCHEMBL21074623 0.85 THRB (0.38) BCHEPPARG
SCHEMBL21074684 0.84 PPARG (0.32) PPARGPPARA
SCHEMBL21074619 0.80 LSS (0.33) HPGD
SCHEMBL19722518 0.79 CYP2C9 (0.37) BCHE
SCHEMBL21074603 0.79 CYP2C9 (0.37) —

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
EP-3495343-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2019-06-12 — — EP disclosed
US-20190169502-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2019-06-06 — — 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 (1 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-20190169502-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE PLD1, AP3D1, CCND1 BCHE 3637/4885ACHE 4504/4885PPARG 3498/4885

“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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