SCHEMBL7362935

SCHEMBL7362935

CC(=O)Nc1ccc(C=CC(=O)Nc2cccc(-c3cccc(Nc4ncccc4[N+](=O)[O-])c3)c2)cn1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.46
MAPT P10636 8/20 0.46
MEN1 O00255 8/20 0.46
POLB P06746 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 8/20 0.43
NPC1 O15118 7/20 0.43
ALDH1A1 P00352 6/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
TP53 P04637 1/20 0.42
PKM P14618 1/20 0.42
EGFR P00533 4/20 0.42
LMNA P02545 3/20 0.42
NFKB1 P19838 2/20 0.41
MAPK1 P28482 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41

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
SCHEMBL7362930 1.00 KMT2A (0.46) KMT2AMAPTMEN1POLBTDP1
SCHEMBL7367425 0.87 MAPT (0.46) KMT2AMAPTMEN1POLBTDP1
SCHEMBL7367418 0.87 MAPT (0.46) KMT2AMAPTMEN1POLBTDP1
SCHEMBL7362037 0.86 HDAC1 (0.46) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL7362038 0.86 HDAC1 (0.46) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL7359779 0.84 MAPT (0.49) KMT2AMAPTMEN1POLBTDP1
SCHEMBL7359782 0.84 MAPT (0.49) KMT2AMAPTMEN1POLBTDP1
SCHEMBL6792229 0.83 MEN1 (0.59) KMT2AMAPTMEN1RAB9ANPC1
SCHEMBL7363300 0.83 MAPT (0.48) KMT2AMAPTMEN1POLBTDP1
SCHEMBL7363299 0.82 MAPT (0.45) KMT2AMAPTMEN1POLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874845-B1 PYRIDO (2,3-B) PYRAZINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2002-03-06 EP disclosed
US-6117875-A Pyrido (2,3-B) pyrazine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-09-12 US disclosed
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