SCHEMBL3489430

SCHEMBL3489430

O=C(O)NCc1cc(Oc2ccc(F)c(F)c2)ccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
ALDH1A1 P00352 1/20 0.47
POLB P06746 1/20 0.47
ALDH3A1 P30838 1/20 0.43
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
SIRT5 Q9NXA8 2/20 0.39
MITF O75030 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SOS1 Q07889 1/20 0.38
HTT P42858 2/20 0.38

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
SCHEMBL3489426 1.00 MAPT (0.47) MAPTALDH1A1POLBALDH3A1CARM1
SCHEMBL3487468 0.91 MEN1 (0.42) MAPTALDH1A1POLBMEN1KMT2A
SCHEMBL3487476 0.91 MEN1 (0.42) MAPTALDH1A1POLBMEN1KMT2A
SCHEMBL3487281 0.91 HTR2A (0.43) MAPTALDH1A1POLBMEN1KMT2A
SCHEMBL3487273 0.91 HTR2A (0.43) MAPTALDH1A1POLBMEN1KMT2A
SCHEMBL3487917 0.89 HSPB1 (0.46) MAPTALDH1A1MEN1KMT2ACRHBP
SCHEMBL3487910 0.89 HSPB1 (0.46) MAPTALDH1A1MEN1KMT2ACRHBP
SCHEMBL3488903 0.88 SIRT5 (0.43) MAPTALDH1A1POLBMEN1KMT2A
SCHEMBL3488908 0.88 SIRT5 (0.43) MAPTALDH1A1POLBMEN1KMT2A
SCHEMBL3487345 0.86 MAPK1 (0.46) MAPTALDH1A1POLBMEN1KMT2A

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 MAPT 4610/4885ALDH1A1 698/4885POLB 4052/4885

“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.