SCHEMBL16226881

SCHEMBL16226881

COc1c(C=O)cc(O)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.60
▸ ALDH1A1 P00352 6/20 0.60
▸ LCK P06239 1/20 0.60
▸ GLA P06280 1/20 0.60
▸ THRB P10828 1/20 0.60
▸ LIMK1 P53667 1/20 0.60
▸ LIMK2 P53671 1/20 0.60
▸ KMT2A Q03164 8/20 0.49
▸ MEN1 O00255 7/20 0.49
▸ TDP1 Q9NUW8 3/20 0.49
▸ MAOA P21397 2/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ TTR P02766 1/20 0.49
▸ CYP1A1 P04798 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ HSPD1 P10809 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ ALOX12 P18054 1/20 0.49

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
SCHEMBL19461410 0.83 MAPT (0.61) MAPTALDH1A1LCKGLATHRB
SCHEMBL9177114 0.80 MAPT (0.54) MAPTALDH1A1LCKGLATHRB
SCHEMBL27870090 0.80 MEN1 (0.66) MAPTALDH1A1LCKGLATHRB
Damnacanthal SCHEMBL29356591 0.75 MAPT (1.00) MAPTALDH1A1LCKGLATHRB
Damnacanthal SCHEMBL147246 0.75 MAPT (1.00) MAPTALDH1A1LCKGLATHRB
SCHEMBL1149730 0.75 MAPT (0.66) MAPTALDH1A1LCKGLATHRB
SCHEMBL3277257 0.74 KMT2A (0.61) MAPTALDH1A1LCKGLATHRB
SCHEMBL11691658 0.73 MAPT (0.63) MAPTALDH1A1LCKGLATHRB
SCHEMBL19478231 0.73 MAPT (0.56) MAPTALDH1A1LCKGLATHRB
SCHEMBL22394347 0.72 PIM1 (0.63) MAPTALDH1A1THRBKMT2AMEN1

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-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 — — 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-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER IL2RA, CD74, IL2 MAPT 3619/4885ALDH1A1 1004/4885LCK 548/4885

“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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