SCHEMBL7834401

SCHEMBL7834401

CCOC(=O)Cc1ccc2c(c1)CC(n1ccnc1C(=O)O)C2=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.36
NPC1 O15118 1/20 0.35
PKM P14618 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 3/20 0.34
GAA P10253 2/20 0.34
HPGD P15428 2/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LDHA P00338 2/20 0.34
LDHB P07195 1/20 0.34
TP53 P04637 1/20 0.33

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
SCHEMBL8091069 0.92 TBXAS1 (0.36) TBXAS1NPC1PKMNFKB1RAB9A
SCHEMBL8558748 0.81 METAP1 (0.39) PKMALDH1A1GAAKDM4EMEN1
SCHEMBL8880656 0.79 METAP1 (0.38) ALDH1A1GAAHPGDMAPTKDM4E
SCHEMBL7846559 0.79
SCHEMBL8090457 0.79 TBXAS1 (0.37) TBXAS1SMN1; SMN2L3MBTL1ALDH1A1GAA
SCHEMBL8316780 0.79 CYP19A1 (0.45) NPC1RAB9AALDH1A1KDM4EMEN1
SCHEMBL7847087 0.78 KMT2A (0.43) PKMSMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL8881385 0.77 GABRG2 (0.41) SMN1; SMN2L3MBTL1ALDH1A1GAAHPGD
SCHEMBL8880066 0.77 HRH1 (0.43) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL8880563 0.77 GABRG2 (0.38) SMN1; SMN2ALDH1A1GAAHPGDMAPT

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-0820455-B1 5H, 10H-IMIDAZO [1,2-a]INDENO [1,2-e]PYRAZIN-4-ONE DERIVATIVES, PREPARATION THEREOF, AND DRUGS CONTAINING SAID DERIVATIVES AVENTIS PHARMA SA (FR) 2001-10-31 EP disclosed
EP-0820455-A1 5H, 10H-IMIDAZO [1,2-a]INDENO [1,2-e]PYRAZIN-4-ONE DERIVATIVES, PREPARATION THEREOF, AND DRUGS CONTAINING SAID DERIVATIVES Aventis Pharma S.A. (FR) 1998-01-28 EP disclosed
WO-1996031511-A1 5H,10H-IMIDAZO[1,2-a]INDENO[1,2-e]PYRAZIN-4-ONE DERIVATIVES, PREPARATION THEREOF, AND DRUGS CONTAINING SAID DERIVATIVES RHONE-POULENC RORER S.A. (FR) 1996-10-10 WO disclosed