SCHEMBL22459332

SCHEMBL22459332

C=C(COC)C(=O)OCCOc1ccc(-c2ccc(OCCOC(=O)C(=C)COC)cc2OC)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 1/20 0.39
▸ CHEK2 O96017 1/20 0.39
▸ SYK P43405 1/20 0.38
▸ CTSA P10619 1/20 0.37
▸ CYP11B1 P15538 1/20 0.37
▸ CYP11B2 P19099 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CYP1A1 P04798 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2E1 P05181 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C8 P10632 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2A6 P11509 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP4B1 P13584 1/20 0.36
▸ CYP2B6 P20813 1/20 0.36
▸ CYP3A5 P20815 1/20 0.36
▸ CYP2A7 P20853 1/20 0.36
▸ CYP3A7 P24462 1/20 0.36

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
SCHEMBL22459819 0.96 PDE3B (0.39) PPARDCHEK2SYKCTSACYP11B1
SCHEMBL22459247 0.96 POLB (0.42) PPARDCHEK2SYKCTSACYP11B1
SCHEMBL22459706 0.94 SYK (0.36) PPARDCHEK2SYKCTSACYP11B1
SCHEMBL22459823 0.93 THRB (0.44) PPARDCHEK2SYKCTSACYP11B1
SCHEMBL22459568 0.92 PPARG (0.39) PPARDSYKCYP11B1CYP11B2MAPT
SCHEMBL22459221 0.92 TDP1 (0.36) PPARDCHEK2SYKCTSACYP11B1
SCHEMBL22459362 0.91 THRB (0.37) PPARDCHEK2SYKCTSACYP11B1
SCHEMBL22459860 0.88 EGFR (0.43) PPARDCHEK2CYP11B1CYP11B2MAPT
SCHEMBL22459811 0.87 EGFR (0.40) PPARDCHEK2MAPTFFAR4PRKAB2
SCHEMBL22459417 0.87 BACE1 (0.39) PPARDCHEK2SYKMAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PPARD 3090/4885CHEK2 4093/4885SYK 1420/4885

“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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