SCHEMBL2093009

SCHEMBL2093009

O=C(O)c1c[nH]c2nc(N3CCC3)c(Br)cc2c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 3/20 0.44
PIM1 P11309 2/20 0.44
MAPKAPK3 Q16644 2/20 0.40
RPS6KB1 P23443 1/20 0.40
MATK P42679 1/20 0.40
DYRK1A Q13627 1/20 0.40
AURKB Q96GD4 1/20 0.40
CSNK2A1 P68400 3/20 0.38
CDK2 P24941 1/20 0.38
FLT4 P35916 1/20 0.38
PRKCD Q05655 1/20 0.38
PAK1 Q13153 1/20 0.38
PRKD2 Q9BZL6 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
DYRK3 O43781 1/20 0.38
SRPK1 Q96SB4 1/20 0.38
CSNK1G1 Q9HCP0 1/20 0.38
ADORA2A P29274 4/20 0.37
KDM4E B2RXH2 2/20 0.36
CSNK2A2 P19784 2/20 0.36

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
SCHEMBL2094434 0.98 PIM3 (0.44) PIM3PIM1MAPKAPK3RPS6KB1MATK
SCHEMBL2092155 0.91 LMNA (0.44) PIM3PIM1MAPKAPK3RPS6KB1MATK
SCHEMBL2092200 0.88 PIM3 (0.52) PIM3PIM1MAPKAPK3RPS6KB1MATK
SCHEMBL2095834 0.85 CSNK2A1 (0.42) PIM3PIM1MAPKAPK3RPS6KB1MATK
SCHEMBL2097125 0.85 LMNA (0.48) PIM3PIM1MAPKAPK3RPS6KB1MATK
SCHEMBL2093405 0.83 CSNK2A1 (0.42) PIM3PIM1MAPKAPK3RPS6KB1MATK
SCHEMBL2094951 0.83 LMNA (0.48) PIM3PIM1MAPKAPK3RPS6KB1MATK
SCHEMBL2095731 0.82 ALDH1A1 (0.46) PIM3PIM1MAPKAPK3RPS6KB1MATK
SCHEMBL2092344 0.81 PIM3 (0.41) PIM3PIM1MAPKAPK3RPS6KB1MATK
SCHEMBL2092612 0.76 LMNA (0.44) PIM3PIM1MAPKAPK3RPS6KB1MATK

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
US-20030232818-A1 Antibacterial compounds ABBVIE INC. 2003-12-18 US claimed
US-8163769-B2 1,8-naphthyridine derivatives ABBOTT LABORATORIES (US) 2012-04-24 US disclosed
US-20030232818-A1 Antibacterial compounds ABBVIE INC. 2003-12-18 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-20030232818-A1 Antibacterial compounds PGLS, UGT1A1, CASP1 PIM3 3424/4885PIM1 2080/4885MAPKAPK3 2241/4885

“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.