SCHEMBL1490941

SCHEMBL1490941

CC(C)(CNc1c([N+](=O)[O-])cnc2cc(Br)cnc12)NC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 9/20 0.40
LATS1 O95835 1/20 0.39
GSTP1 P09211 1/20 0.34
GSTM2 P28161 1/20 0.34
PDGFRB P09619 1/20 0.33
PDGFRA P16234 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP13 P45452 1/20 0.33
MET P08581 1/20 0.33
MAPT P10636 3/20 0.32
ALDH1A1 P00352 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL1491008 0.85 AAK1 (0.41) AAK1LATS1
SCHEMBL1490885 0.84 LMNA (0.33) PDGFRBPDGFRAMAPTL3MBTL1SMN1; SMN2
SCHEMBL4151900 0.84 LATS1 (0.43) AAK1LATS1GSTP1GSTM2MAPT
SCHEMBL1490888 0.82 MAPT (0.33) PDGFRBPDGFRAMETMAPTMEN1
SCHEMBL1041911 0.79 MEN1 (0.45) AAK1LATS1METMAPTALDH1A1
SCHEMBL1490782 0.78 CYP1A2 (0.36) AAK1LATS1MAPTALDH1A1KDM4E
Hydrochloric Acid SCHEMBL1490846 0.78 CYP1A2 (0.36) AAK1LATS1MAPTALDH1A1KDM4E
SCHEMBL1490946 0.78 MET (0.35) AAK1GSTP1GSTM2METMAPT
SCHEMBL1490236 0.74 MAPT (0.46) MAPTALDH1A1MEN1KMT2ATDP1
SCHEMBL3168177 0.74 MAPT (0.39) MAPTALDH1A1KDM4EMEN1KMT2A

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-7897609-B2 Aryl substituted imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-03-01 US disclosed
US-20070219228-A1 Aryl substituted imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2007-09-20 US disclosed
WO-2006038923-A2 ARYL SUBSTITUTED IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-04-13 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-20070219228-A1 Aryl substituted imidazonaphthyridines IL2, IRF3, EIF2AK2 AAK1 2808/4885LATS1 3526/4885GSTP1 416/4885

“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.