SCHEMBL12375232

SCHEMBL12375232

COc1cc(/C=C/C(=O)c2c(O)cc(O)cc2OC)cc(OC)c1OC

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.71
KMT2A Q03164 4/20 0.71
MEN1 O00255 3/20 0.71
KCNA3 P22001 1/20 0.71
NPSR1 Q6W5P4 1/20 0.71
ABCG2 Q9UNQ0 5/20 0.67
KRAS P01116 1/20 0.61
TDP1 Q9NUW8 3/20 0.61
CYP3A4 P08684 3/20 0.61
KDM4E B2RXH2 3/20 0.61
HPGD P15428 3/20 0.61
APP P05067 1/20 0.61
MCL1 Q07820 1/20 0.61
ALDH1A1 P00352 3/20 0.60
ABCB1 P08183 2/20 0.60
LMNA P02545 1/20 0.60
NFKB1 P19838 1/20 0.60
DPP4 P27487 1/20 0.60
NFKB2 Q00653 1/20 0.60
RELA Q04206 1/20 0.60

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
SCHEMBL30545313 0.90 ABCG2 (0.82) MAPTKMT2AMEN1ABCG2KRAS
SCHEMBL2288475 0.86 TNFRSF1A (0.61) MAPTKMT2AMEN1KCNA3NPSR1
SCHEMBL2288459 0.86 TNFRSF1A (0.61) MAPTKMT2AMEN1KCNA3NPSR1
SCHEMBL31384903 0.85 ABCG2 (0.83) MAPTKMT2AMEN1KCNA3NPSR1
SCHEMBL1938672 0.85 MEN1 (0.83) MAPTKMT2AMEN1KCNA3NPSR1
SCHEMBL25202026 0.85 ABCG2 (0.83) MAPTKMT2AMEN1KCNA3NPSR1
SCHEMBL1938668 0.85 MEN1 (0.83) MAPTKMT2AMEN1KCNA3NPSR1
Helichrysetin SCHEMBL2126372 0.84 MAPT (0.82) MAPTKMT2AMEN1KCNA3NPSR1
Helichrysetin SCHEMBL2126376 0.84 MAPT (0.82) MAPTKMT2AMEN1KCNA3NPSR1
Helichrysetin SCHEMBL30382622 0.84 MAPT (0.82) MAPTKMT2AMEN1KCNA3NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9061984-B2 Compounds related to chalcones and benzothienopyrimidines, their synthesis, and uses to treat diseases UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2015-06-23 US disclosed
US-9061984-B2 Compounds related to chalcones and benzothienopyrimidines, their synthesis, and uses to treat diseases UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2015-06-23 US disclosed
US-20110190325-A1 COMPOUNDS, THEIR SYNTHESES, AND THIER USES THE JOHNS HOPKINS UNIVERSITY 2011-08-04 US disclosed
US-20110190325-A1 COMPOUNDS, THEIR SYNTHESES, AND THIER USES THE JOHNS HOPKINS UNIVERSITY 2011-08-04 US disclosed
WO-2010019861-A1 COMPOUNDS, THEIR SYNTHESES, AND THEIR USES UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2010-02-18 WO 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-20110190325-A1 COMPOUNDS, THEIR SYNTHESES, AND THIER USES TERT, TYMS, NISCH MAPT 2194/4885KMT2A 1587/4885MEN1 37/4885

“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.