SCHEMBL27249689

SCHEMBL27249689

CC(=O)Nc1cccc2c1ncn2C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
MAPT P10636 1/20 0.49
DDB1 Q16531 2/20 0.47
CRBN Q96SW2 2/20 0.47
SYK P43405 5/20 0.47
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
EGLN1 Q9GZT9 1/20 0.44
NR1H4 Q96RI1 2/20 0.43
HPGD P15428 1/20 0.42
LCK P06239 1/20 0.41
MAOA P21397 1/20 0.39

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
SCHEMBL27249731 0.84 SYK (0.44) ALDH1A1MAPTDDB1CRBNSYK
SCHEMBL6118655 0.83 DDB1 (0.45) ALDH1A1MAPTDDB1CRBNSYK
SCHEMBL24534324 0.82 SYK (0.51) ALDH1A1DDB1CRBNSYKMEN1
SCHEMBL30514197 0.82 SYK (0.51) ALDH1A1DDB1CRBNSYKMEN1
SCHEMBL7358971 0.78 NR1H4 (0.46) ALDH1A1MAPTSYKMEN1KMT2A
SCHEMBL27249730 0.77 KDM4E (0.53) ALDH1A1MAPTDDB1CRBNHPGD
SCHEMBL29173521 0.77 MCL1 (0.55) ALDH1A1MAPTSYKMEN1KMT2A
SCHEMBL13135975 0.76 NR1H4 (0.42) ALDH1A1MEN1KMT2ANR1H4HPGD
SCHEMBL27249868 0.74 CDK1 (0.48) ALDH1A1MAPTDDB1CRBNSYK
SCHEMBL6117440 0.73 SYK (0.40) MAPTDDB1CRBNSYKMEN1

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-20240239801-A1 PYRIMIDO[5,4,D]PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF Université de Montréal (CA) 2024-07-18 US disclosed
US-20240239801-A1 PYRIMIDO[5,4,D]PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF Université de Montréal (CA) 2024-07-18 US disclosed
US-20240217971-A1 PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS USES THEREOF FOR TREATING A PROLIFERATIVE DISEASE Université de Montréal (CA) 2024-07-04 US disclosed
US-20240217971-A1 PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS USES THEREOF FOR TREATING A PROLIFERATIVE DISEASE Université de Montréal (CA) 2024-07-04 US disclosed
WO-2024077391-A1 THIAZOLO[5,4-D]PYRIMIDINE COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF UNIVERSITE DE MONTREAL (CA) 2024-04-18 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 (2 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 ALDH1A1 1786/4885MAPT 3495/4885DDB1 610/4885
US-20240217971-A1 PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS USES THEREOF FOR TREATING A PROLIFERATIVE DISEASE BRAF, NRAS, DPYD ALDH1A1 1619/4885MAPT 3015/4885DDB1 1115/4885

“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.