SCHEMBL26459489

SCHEMBL26459489

C=C1Oc2ccc(C)cc2O1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.39
CYP2A6 P11509 2/20 0.39
AHR P35869 5/20 0.39
GAA P10253 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 3/20 0.35
ACHE P22303 2/20 0.35
TP53 P04637 2/20 0.35
CYP3A4 P08684 1/20 0.35
THRB P10828 1/20 0.35
ALOX15 P16050 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TRPA1 O75762 1/20 0.35
MMP12 P39900 1/20 0.34

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
SCHEMBL1609847 0.89 AHR (0.48) CYP1A2CYP2A6AHRGAAALDH1A1
SCHEMBL15845332 0.89
SCHEMBL1611847 0.89 AHR (0.48) CYP1A2CYP2A6AHRGAAALDH1A1
SCHEMBL13203015 0.82 AHR (0.54) CYP2A6AHRGAAALDH1A1TDP1
SCHEMBL9874879 0.78 MAOB (0.40) GAAALDH1A1MMP12
SCHEMBL25137402 0.77 MAPT (0.38) CYP1A2CYP2A6AHRGAAALDH1A1
SCHEMBL18622818 0.77 CYP2A6 (0.54) CYP1A2CYP2A6AHRGAAALDH1A1
SCHEMBL16426127 0.77 AHR (0.74) AHRALDH1A1MAPT
SCHEMBL13255905 0.77 AHR (0.38) CYP1A2CYP2A6AHRGAAALDH1A1
SCHEMBL16426097 0.77 AHR (0.74) AHRALDH1A1MAPT

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
US-11639327-B2 Polymerizable compound, and liquid crystal composition and liquid crystal display device using the same DIC CORPORATION (JP) 2023-05-02 US disclosed
US-20230131540-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY ELEMENT AND COMPOUND DIC CORPORATION (JP) 2023-04-27 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-11639327-B2 Polymerizable compound, and liquid crystal composition and liquid crystal display device using the same SKP1, PKN1, KTN1 CYP1A2 3295/4885CYP2A6 4156/4885AHR 4773/4885

“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.