SCHEMBL3488903

SCHEMBL3488903

O=C(O)NCc1cc(Oc2cc(F)cc(F)c2)ccc1[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT5 Q9NXA8 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.40
MAPK1 P28482 2/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 6/20 0.39
MEN1 O00255 5/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
ALDH1A1 P00352 4/20 0.37
MAPT P10636 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
POLB P06746 1/20 0.37
APP P05067 1/20 0.37
KDM4E B2RXH2 1/20 0.37
FFAR1 O14842 1/20 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
SCHEMBL3488908 1.00 SIRT5 (0.43) SIRT5SMN1; SMN2MAPK1HTTKMT2A
SCHEMBL3489485 0.93 SIRT5 (0.41) SIRT5SMN1; SMN2MAPK1HTTKMT2A
SCHEMBL3489491 0.93 SIRT5 (0.41) SIRT5SMN1; SMN2MAPK1HTTKMT2A
SCHEMBL3487174 0.92 EPAS1 (0.45) SIRT5SMN1; SMN2MAPK1HTTKMT2A
SCHEMBL3487202 0.92 PTPN1 (0.41) SIRT5SMN1; SMN2MAPK1HTTKMT2A
SCHEMBL3487209 0.92 PTPN1 (0.41) SIRT5SMN1; SMN2MAPK1HTTKMT2A
SCHEMBL3487168 0.92 EPAS1 (0.45) SIRT5SMN1; SMN2MAPK1HTTKMT2A
SCHEMBL3487910 0.91 HSPB1 (0.46) SIRT5SMN1; SMN2MAPK1HTTKMT2A
SCHEMBL3487917 0.91 HSPB1 (0.46) SIRT5SMN1; SMN2MAPK1HTTKMT2A
SCHEMBL3487452 0.91 SIRT5 (0.53) SIRT5SMN1; SMN2MAPK1HTTKMT2A

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
EP-2138484-B1 FUSED BICYCLIC HETEROARYL DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2015-08-26 EP disclosed
US-20100048564-A1 FUSED BICYCLIC HETEROARYL DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-02-25 US disclosed
EP-2138484-A1 FUSED BICYCLIC HETEROARYL DERIVATIVES Daiichi Sankyo Company, Limited (JP) 2009-12-30 EP 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-20100048564-A1 FUSED BICYCLIC HETEROARYL DERIVATIVE PPARG, GPR119, PPARA SIRT5 1239/4885SMN1; SMN2 4397/4885MAPK1 1347/4885

“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.