SCHEMBL20313670

SCHEMBL20313670

C=C(CO)C(=O)OCCOc1ccc(-c2ccc(-c3ccc(OCCOC(=O)C(=C)CO)cc3)c(OCCCCCCC)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 5/20 0.47
▸ PTPN11 Q06124 6/20 0.46
▸ TP53 P04637 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ RARA P10276 1/20 0.41
▸ PLA2G4B P0C869 1/20 0.41
▸ PTPN1 P18031 1/20 0.40
▸ PTPN6 P29350 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ NR5A1 Q13285 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39

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
SCHEMBL19855671 0.92 RARB (0.41) RARBPTPN11TP53TSHRRARA
SCHEMBL20313671 0.92 RARB (0.44) RARBPTPN11TP53TSHRPLA2G4B
SCHEMBL19855264 0.91 PTPN11 (0.43) RARBPTPN11RARA
SCHEMBL19855664 0.90 PTPN11 (0.46) PTPN11TSHRPLA2G4B
SCHEMBL20313693 0.87 RARB (0.39) RARBPTPN11TSHRRARA
SCHEMBL19855276 0.87 RARB (0.44) RARBPTPN11TP53TSHRRARA
SCHEMBL19854384 0.87 RARB (0.44) RARBPTPN11TP53TSHRRARA
SCHEMBL19855659 0.86 PTPN11 (0.39) RARBPTPN11RARAPTPN1PTPN6
SCHEMBL19855218 0.85 RARB (0.40) RARBPTPN11TP53TSHR
SCHEMBL20313682 0.85 PTPN11 (0.40) RARBPTPN11TSHR

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-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 — — US disclosed
EP-3351525-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2018-07-25 — — EP disclosed
US-20180179443-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-06-28 — — US disclosed
US-20180179443-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-06-28 — — 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-20180179443-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE C1S, CCND1, C5 RARB 3791/4885PTPN11 3649/4885TP53 1548/4885

“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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