SCHEMBL1868375

SCHEMBL1868375

NC(=O)c1cc(Nc2ncc3cc(Br)ccc3n2)ccc1N1CCOCC1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SYK P43405 9/20 0.56
MAPK9 P45984 4/20 0.51
MAPK10 P53779 4/20 0.51
MAPK8 P45983 2/20 0.49
STAT6 P42226 7/20 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
SCHEMBL14146863 0.89 SYK (0.56) SYKMAPK9MAPK10MAPK8STAT6
SCHEMBL3502715 0.86 SYK (0.54) SYKMAPK9MAPK10MAPK8STAT6
SCHEMBL13363164 0.81 EPHB4 (0.50) SYKMAPK9MAPK10MAPK8STAT6
SCHEMBL1866937 0.81 MAPT (0.60) SYKMAPK10STAT6
SCHEMBL3504716 0.75 CSF1R (0.43) SYK
SCHEMBL1865052 0.75 BRAF (0.50) SYKMAPK10MAPK8
SCHEMBL735531 0.72 SYK (1.00) SYK
SCHEMBL1475718 0.72 SYK (0.48) SYKMAPK9MAPK10MAPK8
SCHEMBL16466605 0.72 SYK (0.82) SYKMAPK9MAPK10
SCHEMBL1632767 0.72 JAK2 (0.54) SYKMAPK9MAPK10MAPK8STAT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008079988-A9 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS AG (CH) 2011-05-12 WO claimed
US-20100216767-A1 QUINAZOLINES FOR PDK1 INHIBITION AIKAWA MINA 2010-08-26 US claimed
WO-2008079988-A9 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS AG (CH) 2011-05-12 WO disclosed
US-20100216767-A1 QUINAZOLINES FOR PDK1 INHIBITION AIKAWA MINA 2010-08-26 US disclosed
US-20100216767-A1 QUINAZOLINES FOR PDK1 INHIBITION AIKAWA MINA 2010-08-26 US disclosed
US-20100216767-A1 QUINAZOLINES FOR PDK1 INHIBITION AIKAWA MINA 2010-08-26 US disclosed
US-20100121052-A1 Novel compounds for treating proliferative diseases JAIN RAMA 2010-05-13 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 (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-20100216767-A1 QUINAZOLINES FOR PDK1 INHIBITION PDK1, PDK2, PDK3 SYK 4095/4885MAPK9 185/4885MAPK10 338/4885
US-20100121052-A1 Novel compounds for treating proliferative diseases PDK1, PDK2, PDK3 SYK 4070/4885MAPK9 232/4885MAPK10 202/4885

“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.