SCHEMBL4514739

SCHEMBL4514739

Cc1ccc2oc(-c3cccc(NC(=O)c4ccccc4[N+](=O)[O-])c3)nc2c1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.67
MAPT P10636 8/20 0.62
PPARG P37231 2/20 0.62
DUSP1 P28562 2/20 0.60
HPGD P15428 2/20 0.59
GAA P10253 1/20 0.59
HSD17B10 Q99714 1/20 0.59
P2RY14 Q15391 1/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
POLB P06746 1/20 0.59
MAPK1 P28482 1/20 0.59
MMP2 P08253 1/20 0.57
MMP9 P14780 1/20 0.57
MMP8 P22894 1/20 0.57
MMP13 P45452 1/20 0.57
THRB P10828 4/20 0.57

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
SCHEMBL4513697 0.84 PTGES (0.77) TP53MAPTPPARGDUSP1
SCHEMBL27188272 0.84 PPARG (0.74) TP53MAPTPPARGHPGDHSD17B10
SCHEMBL4503739 0.84 TP53 (0.84) TP53MAPTPPARGDUSP1HPGD
SCHEMBL13576606 0.84 MAPT (0.70) TP53MAPTPPARGHPGDHSD17B10
SCHEMBL26687955 0.82 TP53 (0.82) TP53MAPTPPARGDUSP1HPGD
SCHEMBL12127299 0.81 PPARG (0.73) TP53MAPTPPARGMEN1KMT2A
SCHEMBL4501791 0.80 TP53 (0.73) TP53MAPTDUSP1HPGDGAA
SCHEMBL2555051 0.80 SMN1; SMN2 (0.68) TP53MAPTHPGDGAAHSD17B10
SCHEMBL13576558 0.79 KDM4E (0.64) TP53MAPTDUSP1HSD17B10P2RY14
SCHEMBL24711762 0.78 MAPT (0.67) TP53MAPTHPGDHSD17B10MEN1

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 1 patent. 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

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 TP53 2523/4885MAPT 270/4885PPARG 280/4885

“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.