SCHEMBL22459808

SCHEMBL22459808

C=C(COC)C(=O)OCCCc1ccc(-c2ccc(CCCOC(=O)C(=C)COC)cc2OC)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TNKS2 Q9H2K2 1/20 0.42
▸ MET P08581 5/20 0.41
▸ AKR1B10 O60218 1/20 0.39
▸ AKR1B1 P15121 1/20 0.39
▸ PPARG P37231 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ ALOX5 P09917 2/20 0.36
▸ MTNR1A P48039 1/20 0.36
▸ MTNR1B P49286 1/20 0.36
▸ FKBP1A P62942 2/20 0.36
▸ ADRB1 P08588 1/20 0.36
▸ ADRB3 P13945 1/20 0.36
▸ CHRM5 P08912 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ CHRM3 P20309 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
SCHEMBL22459240 0.96 TNKS2 (0.41) TNKS2METAKR1B10AKR1B1PPARG
SCHEMBL22459838 0.93 MET (0.43) TNKS2METAKR1B10AKR1B1ALOX5
SCHEMBL22459568 0.91 PPARG (0.39) TNKS2METAKR1B10AKR1B1PPARG
SCHEMBL22459833 0.89 RARB (0.37) TNKS2METPPARGPPARA
SCHEMBL22459277 0.88 EGFR (0.37) TNKS2METAKR1B10AKR1B1ALOX5
SCHEMBL22459377 0.87 RARB (0.43) METAKR1B10AKR1B1PPARG
SCHEMBL22459276 0.87 EGFR (0.41) TNKS2METAKR1B10AKR1B1PPARG
SCHEMBL22459369 0.86 RARB (0.35) TNKS2METAKR1B10AKR1B1PPARG
SCHEMBL22459412 0.85 LMNA (0.40) METAKR1B10AKR1B1
SCHEMBL22459252 0.85 LMNA (0.40) METAKR1B10AKR1B1

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 TNKS2 4341/4885MET 3102/4885AKR1B10 3247/4885

“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.

Send feedback