SCHEMBL4513288

SCHEMBL4513288

O=[N+]([O-])c1ccc(Cl)c(-c2nc3ccc(Cl)cc3o2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.59
NPC1 O15118 5/20 0.55
RAB9A P51151 5/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
MAPT P10636 4/20 0.55
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
KMT2A Q03164 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MMP2 P08253 2/20 0.50
MMP9 P14780 2/20 0.50
MMP8 P22894 2/20 0.50
MMP13 P45452 2/20 0.50
THRB P10828 1/20 0.49
PPARG P37231 5/20 0.48
LMNA P02545 1/20 0.47
CASP3 P42574 1/20 0.47
NPBWR1 P48145 1/20 0.47
MCL1 Q07820 1/20 0.44
ATM Q13315 1/20 0.44

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
SCHEMBL4505279 0.90 MAPT (0.58) APEX1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL2690401 0.86 MMP2 (0.63) APEX1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL10590415 0.83 PIK3CG (0.54) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL914083 0.81 APEX1 (0.68) APEX1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL2247322 0.80 RAB9A (0.75) APEX1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4513561 0.80 MAPT (0.60) APEX1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4501854 0.80 MMP2 (0.67) NPC1RAB9ASMN1; SMN2MAPTMMP2
SCHEMBL5834599 0.79 RAB9A (0.54) APEX1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4514393 0.78 MAPT (0.60) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL2242707 0.78 RAB9A (0.67) NPC1RAB9ASMN1; SMN2MAPTMEN1

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-20090258917-A1 Benzoxazoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-10-15 US disclosed
EP-1933834-A1 BENZOXAZOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2008-06-25 EP disclosed
WO-2007042816-A1 BENZOXAZOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2007-04-19 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-20090258917-A1 Benzoxazoles Useful in the Treatment of Inflammation IL4I1, EPX, IL4 APEX1 4347/4885NPC1 4501/4885RAB9A 3680/4885

“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.