SCHEMBL5017339

SCHEMBL5017339

COc1cc2c(Oc3ccc4cc(C)[nH]c4c3)cnnc2cc1OCC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 3/20 0.44
CSF1R P07333 1/20 0.42
NSD2 O96028 2/20 0.42
EHMT2 Q96KQ7 2/20 0.42
DNMT3A Q9Y6K1 1/20 0.40
SLC2A1 P11166 1/20 0.40
GPR119 Q8TDV5 3/20 0.39
KDM1A O60341 1/20 0.39
RCOR1 Q9UKL0 1/20 0.39
TLR9 Q9NR96 3/20 0.39
TLR7 Q9NYK1 2/20 0.39
TBK1 Q9UHD2 1/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
PDE10A Q9Y233 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL5017592 0.85 KDR (0.47) CHEK2CSF1RNSD2EHMT2DNMT3A
SCHEMBL5016826 0.84 PDE10A (0.45) CHEK2NSD2EHMT2DNMT3AGPR119
SCHEMBL5015530 0.83 EGFR (0.42) EHMT2PDE4APDE4DPDE10A
SCHEMBL29111046 0.83 PDGFRA (0.43) CHEK2CSF1RNSD2EHMT2DNMT3A
SCHEMBL4380906 0.81 RAF1 (0.48) CHEK2CSF1R
SCHEMBL5016778 0.78 NSD2 (0.49) NSD2EHMT2DNMT3AGPR119KDM1A
SCHEMBL13998242 0.77 EGFR (0.42) EHMT2PDE4APDE4DPDE10A
SCHEMBL666409 0.77 BRAF (0.55) GPR119PDE4APDE4BPDE4CPDE4D
SCHEMBL7127947 0.77 MAP3K5 (0.35) PDE10A
SCHEMBL664666 0.75 KDR (0.46) CHEK2CSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1309587-B1 CINNOLINE COMPOUNDS ASTRAZENECA AB (SE) 2008-12-31 EP disclosed
US-6887874-B2 Cinnoline compounds ASTRAZENECA AB (SE) 2005-05-03 US disclosed
US-20030212055-A1 Cinnoline compounds ASTRAZENECA AB (SE) 2003-11-13 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 (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-20030212055-A1 Cinnoline compounds VEGFA, PGF, CCR7 CHEK2 2101/4885CSF1R 398/4885NSD2 2378/4885

“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.