SCHEMBL8028284

SCHEMBL8028284

CCOC(=O)CCn1c(Cc2ccc(C#N)cc2)nc2c(NS(=O)(=O)c3ccccc3)cccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 2/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
F2 P00734 2/20 0.40
CNR2 P34972 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
THRB P10828 2/20 0.39
HPGD P15428 2/20 0.39
BLM P54132 2/20 0.39
PLEC Q15149 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
BRPF1 P55201 3/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
APAF1 O14727 1/20 0.37
NSD2 O96028 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 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
SCHEMBL8029746 0.92 GLO1 (0.41) GLO1TSHRKMT2AF2CNR2
SCHEMBL8026525 0.88 ALDH1A1 (0.41) GLO1TSHRKMT2AF2CNR2
SCHEMBL8017545 0.87 F2 (0.48) GLO1KMT2AF2CNR2BRPF1
SCHEMBL8026558 0.86 GLO1 (0.48) GLO1F2CNR2BRPF1SLC40A1
SCHEMBL8026444 0.84 GLO1 (0.46) GLO1F2CNR2SLC40A1BRD4
SCHEMBL8028279 0.83 F2 (0.59) F2CNR2ALDH1A1SMN1; SMN2BRPF1
SCHEMBL8032287 0.83 GLO1 (0.44) GLO1F2SLC40A1BRD4AGTR1
SCHEMBL8028576 0.82 CDC25A (0.48) GLO1KMT2AF2ALDH1A1THRB
SCHEMBL8026661 0.82 GLO1 (0.49) GLO1F2BRPF1MAPTRXFP1
SCHEMBL8101752 0.82 GLO1 (0.43) GLO1TSHRKMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114532-A ANTICOAGULANT BOEHRINGER INGELHEIM PHARMA KG (DE) 2000-09-05 US disclosed