SCHEMBL16616651

SCHEMBL16616651

COc1ccc(C(=O)C=Cc2c(OC)cccc2OC)c(OC)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 8/20 0.72
MAPT P10636 5/20 0.71
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
NPC1 O15118 2/20 0.71
RAB9A P51151 2/20 0.71
TNFRSF1A P19438 1/20 0.70
PDE4A P27815 1/20 0.68
PDE4B Q07343 1/20 0.68
PDE4C Q08493 1/20 0.68
PDE4D Q08499 1/20 0.68
XDH P47989 1/20 0.65
CYP1A1 P04798 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2D6 P10635 1/20 0.62
CYP1B1 Q16678 1/20 0.62
MAPK1 P28482 2/20 0.61
USP2 O75604 1/20 0.61
TLR9 Q9NR96 1/20 0.61

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
SCHEMBL16616648 1.00 ABCG2 (0.72) ABCG2MAPTMEN1KMT2ANPC1
SCHEMBL4456570 0.91 ABCG2 (0.76) ABCG2MAPTMEN1KMT2ANPC1
SCHEMBL4456573 0.91 ABCG2 (0.76) ABCG2MAPTMEN1KMT2ANPC1
SCHEMBL30138963 0.88 ABCG2 (0.75) ABCG2MAPTMEN1KMT2ANPC1
SCHEMBL29443580 0.84 MAPT (0.82) ABCG2MAPTMEN1KMT2ANPC1
SCHEMBL29443563 0.84 MAPT (0.82) ABCG2MAPTMEN1KMT2ANPC1
SCHEMBL4030789 0.83 MAPT (1.00) ABCG2MAPTMEN1KMT2ANPC1
SCHEMBL4030793 0.83 MAPT (1.00) ABCG2MAPTMEN1KMT2ANPC1
Metochalcone SCHEMBL4957703 0.82 ABCG2 (1.00) ABCG2MAPTMEN1KMT2ANPC1
SCHEMBL4456467 0.82 ABCG2 (0.84) ABCG2MAPTMEN1KMT2ACYP1A1

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-9006451-B1 2-anilinonicotinyl based chalcones useful as potential anticancer agents and process for preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-04-14 US disclosed
US-20150099888-A1 2-Anilinonicotinyl Based Chalcones Useful As Potential Anticancer Agents and Process for Preparation Thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-04-09 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-20150099888-A1 2-Anilinonicotinyl Based Chalcones Useful As Potential Anticancer Agents and Process for Preparation Thereof HCCS, WEE2, WEE1 ABCG2 289/4885MAPT 2681/4885MEN1 2511/4885

“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.