SCHEMBL3487141

SCHEMBL3487141

Cc1ccc(F)c(Oc2ccc([N+](=O)[O-])c(CNC(=O)O)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
TDP1 Q9NUW8 2/20 0.42
ALDH1A1 P00352 8/20 0.39
KDM4E B2RXH2 3/20 0.39
KMT2A Q03164 5/20 0.39
LMNA P02545 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MAPK1 P28482 2/20 0.39
HTT P42858 2/20 0.39
MEN1 O00255 3/20 0.39
POLB P06746 2/20 0.39
RECQL P46063 1/20 0.39
TTR P02766 1/20 0.39
PPOX P50336 1/20 0.39
MAPT P10636 3/20 0.38
PYGL P06737 1/20 0.38
PPARG P37231 1/20 0.37

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
SCHEMBL3487146 1.00 L3MBTL1 (0.44) L3MBTL1TDP1ALDH1A1KDM4EKMT2A
SCHEMBL3487713 0.91 ALDH1A1 (0.41) TDP1ALDH1A1KDM4EKMT2ALMNA
SCHEMBL3487709 0.91 ALDH1A1 (0.41) TDP1ALDH1A1KDM4EKMT2ALMNA
SCHEMBL3487984 0.90 NPSR1 (0.43) TDP1ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL3487979 0.90 NPSR1 (0.43) TDP1ALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL3487345 0.90 MAPK1 (0.46) L3MBTL1TDP1ALDH1A1KMT2ALMNA
SCHEMBL3487353 0.90 MAPK1 (0.46) L3MBTL1TDP1ALDH1A1KMT2ALMNA
SCHEMBL3487363 0.87 HSPB1 (0.45) ALDH1A1KDM4EKMT2ASMN1; SMN2MAPK1
SCHEMBL3487359 0.87 HSPB1 (0.45) ALDH1A1KDM4EKMT2ASMN1; SMN2MAPK1
SCHEMBL3487281 0.85 HTR2A (0.43) L3MBTL1TDP1ALDH1A1KDM4EKMT2A

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 L3MBTL1 2253/4885TDP1 4745/4885ALDH1A1 698/4885

“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.