SCHEMBL7690347

SCHEMBL7690347

O=S(=O)(O)c1ccc2cc3nc(-c4cccs4)c(-c4cccs4)nc3cc2c1.[NaH]

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KB2 Q9UBS0 8/20 0.60
SRPK1 Q96SB4 1/20 0.60
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 4/20 0.41
MEN1 O00255 4/20 0.41
MAPT P10636 4/20 0.41
KMT2A Q03164 4/20 0.41
HPGD P15428 3/20 0.41
HSD17B10 Q99714 3/20 0.41
GAA P10253 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 4/20 0.41
HTT P42858 1/20 0.41
SNCA P37840 2/20 0.40
GBA1 P04062 1/20 0.40
NPC1 O15118 1/20 0.38
GLA P06280 1/20 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
SCHEMBL7690357 0.99 RPS6KB2 (0.61) RPS6KB2SRPK1ALDH1A1KDM4EMEN1
SCHEMBL7690349 0.85 RPS6KB2 (0.60) RPS6KB2SRPK1ALDH1A1KDM4EMEN1
SCHEMBL7691270 0.77 TDP1 (0.54) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL7693467 0.76 SNCA (0.38) RPS6KB2SRPK1ALDH1A1HSD17B10SNCA
SCHEMBL7692571 0.76 RPS6KB2 (1.00) RPS6KB2SRPK1ALDH1A1KDM4EMEN1
SCHEMBL7691277 0.76 TDP1 (0.55) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL31060401 0.75 RPS6KB2 (1.00) RPS6KB2SRPK1ALDH1A1KDM4EMEN1
SCHEMBL1905308 0.74 NPC1 (0.62) RPS6KB2SRPK1ALDH1A1KDM4EHPGD
SCHEMBL7693473 0.74 SNCA (0.38) RPS6KB2SRPK1ALDH1A1HSD17B10SNCA
SCHEMBL7692726 0.73 KDM4E (0.51) ALDH1A1KDM4EMEN1MAPTKMT2A

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
WO-2002094796-A2 BENZO[G]QUINOXALINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES AXXIMA PHARMACEUTICALS AG (DE) 2002-11-28 WO claimed
WO-2002094796-A2 BENZO[G]QUINOXALINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES AXXIMA PHARMACEUTICALS AG (DE) 2002-11-28 WO disclosed