SCHEMBL162608

SCHEMBL162608

Cc1cccc2c(Cl)nc(C(F)(F)c3ccc(F)cn3)nc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 3/20 0.36
TNKS2 Q9H2K2 3/20 0.36
PARP2 Q9UGN5 3/20 0.36
ELANE P08246 4/20 0.35
PDE7A Q13946 2/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
PDE7B Q9NP56 1/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
TP53 P04637 1/20 0.31
PARP1 P09874 1/20 0.31
CTNNB1 P35222 3/20 0.31
TCF7L2 Q9NQB0 3/20 0.31
GUCY1B2 O75343 1/20 0.30
GUCY1A2 P33402 1/20 0.30

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
SCHEMBL158446 0.88 PDE7A (0.33) PDE7APARP1P2RX7
SCHEMBL161422 0.88 GRM5 (0.34) P2RX7
SCHEMBL160464 0.85 ENPP3 (0.41)
SCHEMBL162466 0.80 METAP1 (0.38) PDE4APDE4BPDE4CPDE4DGAA
SCHEMBL173588 0.76 AURKA (0.44)
SCHEMBL162259 0.74 TNKS (0.53) TNKSTNKS2PARP2ELANEPARP1
SCHEMBL163623 0.73 NR1H2 (0.35) TP53PARP1
SCHEMBL158172 0.71 ADORA2A (0.41) TNKSTNKS2PARP2PDE4APDE4B
SCHEMBL160936 0.71 ENPP3 (0.36) GAA
SCHEMBL162797 0.71 TRPA1 (0.39)

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
US-8633207-B2 Quinazoline compounds and methods of use thereof AMBIT BIOSCIENCES CORPORATION (US) 2014-01-21 US disclosed
EP-2611789-A1 QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2013-07-10 EP disclosed
WO-2012030948-A1 QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2012-03-08 WO disclosed
US-20120053174-A1 QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION 2012-03-01 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-20120053174-A1 QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF JAK3, JAK2, TYK2 TNKS 225/4885TNKS2 166/4885PARP2 751/4885

“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.