SCHEMBL9976375

SCHEMBL9976375

CC(=O)C1=C(C)Nc2c(c(=O)[nH]c(=O)n2-c2ccccc2)C1c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 3/20 0.48
BRDT Q58F21 3/20 0.48
BRD2 P25440 1/20 0.48
BRD3 Q15059 1/20 0.48
KMT2A Q03164 4/20 0.46
GAA P10253 3/20 0.46
ALDH1A1 P00352 3/20 0.46
POLB P06746 3/20 0.46
MAPT P10636 3/20 0.46
MAPK1 P28482 2/20 0.46
MEN1 O00255 2/20 0.46
USP2 O75604 1/20 0.42
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.40
LIPG Q9Y5X9 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CACNA1D Q01668 1/20 0.38
THRB P10828 1/20 0.38
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL3433034 0.92 BRD4 (0.48) BRD4BRDTBRD2BRD3KMT2A
SCHEMBL2725332 0.86 BRD4 (0.60) BRD4BRDTBRD2BRD3KMT2A
SCHEMBL13012739 0.85 BRD4 (0.46) BRD4BRDTBRD2BRD3KMT2A
SCHEMBL3434014 0.83 BRD4 (0.45) BRD4BRDTBRD2BRD3KMT2A
SCHEMBL3434768 0.81 BRD4 (0.39) BRD4BRDTBRD2BRD3KMT2A
SCHEMBL13013567 0.80 MAOB (0.44) BRD4BRDTBRD2BRD3KMT2A
SCHEMBL13012896 0.79 BRD4 (0.39) BRD4BRDTBRD2BRD3KMT2A
SCHEMBL3432096 0.79 BRD4 (0.39) BRD4BRDTBRD2BRD3KMT2A
SCHEMBL13012731 0.77 BRD4 (0.38) BRD4BRDTBRD2BRD3KMT2A
SCHEMBL3434370 0.76 CACNA2D1 (0.40) BRD4BRDTBRD2BRD3ALDH1A1

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-8629272-B2 Tricyclic pyrimidine derivatives as wnt antagonists DEUTSCHES KREBSFORSCHUNGSZENTRUM (DE) 2014-01-14 US disclosed
US-20120157481-A1 TRICYCLIC PYRIMIDINE DERIVATIVES AS WNT ANTAGONISTS DEUTSCHES KREBSFORSCHUNGSZENTRUM 2012-06-21 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-20120157481-A1 TRICYCLIC PYRIMIDINE DERIVATIVES AS WNT ANTAGONISTS WNT1, WNT3, WNT3A BRD4 1105/4885BRDT 3239/4885BRD2 2261/4885

“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.