SCHEMBL26565845

SCHEMBL26565845

c1ccc(-c2ccc(-c3ccc4cc(-c5ccc(-c6cccc7ccccc67)cc5)ccc4c3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.59
CA1 P00915 2/20 0.59
CA2 P00918 2/20 0.59
CA9 Q16790 2/20 0.59
ESR1 P03372 2/20 0.50
ESR2 Q92731 2/20 0.50
PPARG P37231 7/20 0.49
PPARA Q07869 7/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
PPARD Q03181 1/20 0.49
MCL1 Q07820 1/20 0.49
ACMSD Q8TDX5 1/20 0.49
TNF P01375 1/20 0.49
HSD17B1 P14061 2/20 0.48
HSD17B2 P37059 2/20 0.48
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47

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
SCHEMBL26550598 1.00 CA12 (0.59) CA12CA1CA2CA9ESR1
SCHEMBL26301314 0.90 CA12 (0.51) CA12CA1CA2CA9ESR1
SCHEMBL25816246 0.90 CA12 (0.51) CA12CA1CA2CA9ESR1
SCHEMBL27256298 0.90 CA12 (0.51) CA12CA1CA2CA9ESR1
SCHEMBL27456164 0.90 CA12 (0.51) CA12CA1CA2CA9ESR1
SCHEMBL24527238 0.90 CA12 (0.51) CA12CA1CA2CA9ESR1
SCHEMBL25681234 0.90 CA12 (0.51) CA12CA1CA2CA9ESR1
SCHEMBL26605976 0.90 CA12 (0.51) CA12CA1CA2CA9ESR1
SCHEMBL22187612 0.90 CA12 (0.51) CA12CA1CA2CA9ESR1
SCHEMBL25816692 0.90 CA12 (0.51) CA12CA1CA2CA9ESR1

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-20230337527-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME LAPTO CO., LTD. (KR) 2023-10-19 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-20230337527-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME AOC1, ODC1, PIEZO1 CA12 807/4885CA1 386/4885CA2 1029/4885

“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.