SCHEMBL22459876

SCHEMBL22459876

C=C(COC)C(=O)OCCCc1ccc(-c2ccc(-c3ccc(-c4ccc(CCCOC(=O)C(=C)COC)cc4)cc3OCCCC)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.39
▸ PDE4A P27815 2/20 0.39
▸ PDE4B Q07343 2/20 0.39
▸ PDE4C Q08493 2/20 0.39
▸ PDE4D Q08499 2/20 0.39
▸ PTPN11 Q06124 2/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ PTPN6 P29350 1/20 0.37
▸ ADRB1 P08588 1/20 0.37
▸ ADRB3 P13945 1/20 0.37
▸ RARB P10826 7/20 0.36
▸ S1PR1 P21453 2/20 0.36
▸ RARA P10276 1/20 0.35
▸ RARG P13631 1/20 0.35
▸ CYP11B1 P15538 2/20 0.35
▸ CYP11B2 P19099 2/20 0.35
▸ CYP19A1 P11511 1/20 0.35

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
SCHEMBL22459833 0.95 RARB (0.37) PTPN11RARBCYP11B1CYP11B2CYP19A1
SCHEMBL22459276 0.95 EGFR (0.41) EGFRPDE4APDE4BPDE4CPDE4D
SCHEMBL19855659 0.91 PTPN11 (0.39) PDE4APDE4BPDE4CPDE4DPTPN11
SCHEMBL22459277 0.89 EGFR (0.37) EGFRPDE4APDE4BPDE4CPDE4D
SCHEMBL22459837 0.87 POLB (0.41) PTPN11RARBRARA
SCHEMBL22082240 0.86 RARB (0.38) PDE4APDE4BPDE4CPDE4DPTPN11
SCHEMBL22459840 0.85 RARB (0.34) PDE4APDE4BPDE4CPDE4DRARB
SCHEMBL22459860 0.85 EGFR (0.43) EGFRRARBRARACYP11B1CYP11B2
SCHEMBL22459808 0.84 TNKS2 (0.42) ADRB1ADRB3
SCHEMBL22561079 0.84 LPAR1 (0.33) PDE4APDE4BPDE4CPDE4DRARB

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-3725764-A1 POLYMERIZABLE COMPOUND HAVING METHOXYMETHYL ACRYLIC GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2020-10-21 — — EP disclosed
US-20200299578-A1 POLYMERIZABLE COMPOUND HAVING METHOXYMETHYL ACRYLIC GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2020-09-24 — — 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-20200299578-A1 POLYMERIZABLE COMPOUND HAVING METHOXYMETHYL ACRYLIC GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE SP1, CCND1, CPNE4 EGFR 2937/4885PDE4A 4002/4885PDE4B 4162/4885

“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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