SCHEMBL5283782

SCHEMBL5283782

COc1cc2c(C3C(=O)Nc4nc(C)ncc43)ncnc2cc1OCCOc1ccncc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.38
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
PDE10A Q9Y233 1/20 0.36
PDPK1 O15530 1/20 0.36
MAPK7 Q13164 1/20 0.35
ATM Q13315 2/20 0.35
ENPP1 P22413 1/20 0.35
KDM1A O60341 2/20 0.35
TYK2 P29597 1/20 0.34
NEK9 Q8TD19 1/20 0.34
NEK6 Q9HC98 1/20 0.34
EGFR P00533 1/20 0.34
PDE1B Q01064 1/20 0.34

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
Hydrochloric Acid SCHEMBL5498749 0.99 KDR (0.37) KDRPDE3BPDE3APDE10APDPK1
Hydrochloric Acid SCHEMBL5493969 0.87 KDR (0.44) KDRPDPK1
Hydrochloric Acid SCHEMBL7979000 0.84 EGFR (0.45) KDRPDPK1EGFR
SCHEMBL5274320 0.84 KDR (0.46) KDRMAPK7ATMENPP1EGFR
Hydrochloric Acid SCHEMBL8187414 0.84 KDR (0.34) KDRMAPK7ENPP1PDE1B
Hydrochloric Acid SCHEMBL5502661 0.83 KDR (0.45) KDRMAPK7ATMENPP1EGFR
SCHEMBL5272907 0.77 CHEK1 (0.41) KDRKDM1AEGFR
SCHEMBL5272824 0.77 KDR (0.46) KDRPDPK1ATMKDM1ATYK2
Hydrochloric Acid SCHEMBL5501325 0.77 CHEK1 (0.40) KDRKDM1AEGFR
SCHEMBL7205793 0.73 KDR (0.48) KDRKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1458395-B1 MEDICAL USE OF GSK3-INHIBITING OXINDOLE DERIVATIVES ASTRAZENECA AB (SE) 2007-11-28 EP claimed
US-20050075351-A1 Use ASTRAZENECA AB (SE) 2005-04-07 US claimed
EP-1458395-A1 NEW USE AstraZeneca AB (SE) 2004-09-22 EP claimed
WO-2003053444-A1 NEW USE ASTRAZENECA AB (SE) 2003-07-03 WO claimed
EP-1458395-B1 MEDICAL USE OF GSK3-INHIBITING OXINDOLE DERIVATIVES ASTRAZENECA AB (SE) 2007-11-28 EP disclosed
US-20050075351-A1 Use ASTRAZENECA AB (SE) 2005-04-07 US disclosed
EP-1458395-A1 NEW USE AstraZeneca AB (SE) 2004-09-22 EP disclosed
WO-2003053444-A1 NEW USE ASTRAZENECA AB (SE) 2003-07-03 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 (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-20050075351-A1 Use GSK3A, GSK3B, PYGB KDR 4361/4885PDE3B 545/4885PDE3A 435/4885

“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.