SCHEMBL1938113

SCHEMBL1938113

COc1cc(O)cc(O)c1C(=O)/C=C/c1ccccc1F

nearest known ligand 0.75

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.69
▸ KMT2A Q03164 2/20 0.69
▸ MEN1 O00255 1/20 0.69
▸ KCNA3 P22001 1/20 0.69
▸ NPSR1 Q6W5P4 1/20 0.69
▸ MAOB P27338 5/20 0.66
▸ MAOA P21397 1/20 0.66
▸ ABCG2 Q9UNQ0 5/20 0.62
▸ NR1H4 Q96RI1 3/20 0.57
▸ TP53 P04637 1/20 0.57
▸ CYP3A4 P08684 1/20 0.57
▸ ATM Q13315 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ AR P10275 2/20 0.56
▸ NFKB1 P19838 1/20 0.52
▸ DPP4 P27487 1/20 0.52
▸ NFKB2 Q00653 1/20 0.52
▸ RELA Q04206 1/20 0.52
▸ NFE2L2 Q16236 1/20 0.51

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
SCHEMBL1938117 1.00 MAPT (0.69) MAPTKMT2AMEN1KCNA3NPSR1
SCHEMBL1938121 0.85 KMT2A (0.69) MAPTKMT2AMEN1KCNA3NPSR1
SCHEMBL1938119 0.85 KMT2A (0.69) MAPTKMT2AMEN1KCNA3NPSR1
SCHEMBL26605033 0.85 AURKA (0.60) MAPTNPSR1MAOBMAOAABCG2
SCHEMBL31338641 0.84 KRAS (0.58) MAPTMAOBMAOAABCG2NR1H4
Cardamomin SCHEMBL25194293 0.82 MAPT (1.00) MAPTKMT2AMEN1KCNA3NPSR1
Cardamomin SCHEMBL449220 0.82 MAPT (1.00) MAPTKMT2AMEN1KCNA3NPSR1
Cardamomin SCHEMBL30891551 0.82 MAPT (1.00) MAPTKMT2AMEN1KCNA3NPSR1
Cardamomin SCHEMBL1939236 0.82 MAPT (1.00) MAPTKMT2AMEN1KCNA3NPSR1
SCHEMBL5087999 0.81 MAOB (0.88) MAPTKMT2AMEN1MAOBMAOA

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 9 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-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
US-20110190325-A1 COMPOUNDS, THEIR SYNTHESES, AND THIER USES THE JOHNS HOPKINS UNIVERSITY 2011-08-04 — — US disclosed
EP-2330906-A1 COMPOUNDS, THEIR SYNTHESES, AND THEIR USES University Of Louisville Research Foundation, Inc. (US) 2011-06-15 — — EP disclosed
WO-2010019861-A1 COMPOUNDS, THEIR SYNTHESES, AND THEIR USES UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2010-02-18 — — WO 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.

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