SCHEMBL7363300

SCHEMBL7363300

O=C(/C=C/c1ccnc(O)c1)Nc1cccc(-c2cccc(Nc3ncccc3[N+](=O)[O-])c2)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
POLB P06746 4/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
HPGD P15428 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 5/20 0.46
NPC1 O15118 4/20 0.46
LMNA P02545 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
EGFR P00533 6/20 0.46
TRPV1 Q8NER1 6/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TP53 P04637 1/20 0.44
PKM P14618 1/20 0.44
HTT P42858 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
SCHEMBL7359779 0.91 MAPT (0.49) MAPTPOLBMEN1KMT2AHPGD
SCHEMBL7359782 0.91 MAPT (0.49) MAPTPOLBMEN1KMT2AHPGD
SCHEMBL7487971 0.86 MAPT (0.45) MAPTPOLBMEN1KMT2AHPGD
SCHEMBL7363299 0.86 MAPT (0.45) MAPTPOLBMEN1KMT2AHPGD
SCHEMBL7367833 0.86 EGFR (0.49) MAPTPOLBMEN1KMT2AHPGD
SCHEMBL7367827 0.86 EGFR (0.49) MAPTPOLBMEN1KMT2AHPGD
SCHEMBL7358959 0.85 TLR4 (0.48) MAPTPOLBMEN1KMT2AALDH1A1
SCHEMBL7367589 0.85 MMP1 (0.45) EGFR
SCHEMBL7362930 0.83 KMT2A (0.46) MAPTPOLBMEN1KMT2AHPGD
SCHEMBL7362935 0.83 KMT2A (0.46) MAPTPOLBMEN1KMT2AHPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874845-A1 PYRIDO (2,3-B) PYRAZINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-11-04 EP disclosed
WO-1997024355-A1 PYRIDO (2,3-B) PYRAZINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-07-10 WO disclosed