SCHEMBL3087952

SCHEMBL3087952

CN(Cc1ccc(F)cc1)C(=O)c1nc(N)nc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
KMT2A Q03164 1/20 0.47
NUDT1 P36639 1/20 0.46

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
SCHEMBL3081057 0.91 CYP3A4 (0.53) KMT2A
SCHEMBL16628712 0.89 ADORA3 (0.56) APPNUDT1
SCHEMBL3090418 0.87 SCD5 (0.52) APPKMT2A
SCHEMBL16628815 0.86 ADORA3 (0.58) APPTDP1KMT2A
SCHEMBL13180096 0.86 CYP3A4 (0.47) APPNUDT1
SCHEMBL3089574 0.83 MEN1 (0.52) KMT2A
SCHEMBL13144394 0.83 KDM4E (0.48) KMT2ANUDT1
SCHEMBL13144381 0.83 ADORA3 (0.47)
SCHEMBL16628732 0.81 APP (0.52) APPKMT2A
SCHEMBL16628717 0.81 LMNA (0.50) TDP1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2164833-B1 Quinazolinamide derivatives useful for the treatment of tumour diseases MERCK PATENT GMBH (DE) 2015-04-15 EP claimed
US-8501754-B2 Quinazolinamide derivatives MERCK PATENT GMBH (DE) 2013-08-06 US claimed
US-20100234324-A1 Quinazolinamide derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-09-16 US claimed
EP-2164833-B1 Quinazolinamide derivatives useful for the treatment of tumour diseases MERCK PATENT GMBH (DE) 2015-04-15 EP 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-20100234324-A1 Quinazolinamide derivatives HSP90AB1, HSP90AA1, HSP90AB2P APP 3605/4885TDP1 888/4885KMT2A 3779/4885

“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.