SCHEMBL29338000

SCHEMBL29338000

Cc1c(F)cccc1Nc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.52
MAPT P10636 5/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
KDM4E B2RXH2 2/20 0.52
GLA P06280 1/20 0.52
RECQL P46063 1/20 0.52
ALDH1A1 P00352 5/20 0.47
HSD17B10 Q99714 3/20 0.47
ALOX15 P16050 3/20 0.47
HPGD P15428 2/20 0.47
TSHR P16473 2/20 0.47
TP53 P04637 2/20 0.47
CYP3A4 P08684 1/20 0.47
CDC25B P30305 1/20 0.47
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45

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
SCHEMBL1704615 0.81 MAPT (0.56) GAAMAPTMEN1KMT2ATDP1
SCHEMBL30785818 0.81 MAPT (0.56) GAAMAPTMEN1KMT2ATDP1
SCHEMBL30594032 0.79 MEN1 (0.58) GAAMAPTMEN1KMT2ATDP1
SCHEMBL429858 0.79 MEN1 (0.58) GAAMAPTMEN1KMT2ATDP1
SCHEMBL1118486 0.79 KMT2A (0.56) GAAMAPTMEN1KMT2ATDP1
SCHEMBL4946590 0.77 GAA (0.50) GAAMAPTMEN1KMT2ATDP1
SCHEMBL23369883 0.76 MEN1 (0.52) GAAMAPTMEN1KMT2ATDP1
SCHEMBL22772445 0.76 TDP1 (0.54) GAAMAPTMEN1KMT2ATDP1
SCHEMBL13700692 0.76 MAPT (0.52) GAAMAPTMEN1KMT2ATDP1
SCHEMBL11563994 0.76 MAPT (0.60) GAAMAPTMEN1KMT2ATDP1

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-20240239801-A1 PYRIMIDO[5,4,D]PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF Université de Montréal (CA) 2024-07-18 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-20240239801-A1 PYRIMIDO[5,4,D]PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF NRAS, BRAF, KRAS GAA 2372/4885MAPT 3495/4885MEN1 2257/4885

“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.