SCHEMBL367073

SCHEMBL367073

Cc1ccc(CS(=O)(=O)NC(=O)c2c3ccc(OCC#N)cc3n3ccccc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.45
KMT2A Q03164 7/20 0.45
KDM4E B2RXH2 7/20 0.45
MAPT P10636 7/20 0.45
MEN1 O00255 5/20 0.45
LMNA P02545 3/20 0.45
SAE1 Q9UBE0 2/20 0.45
UBA2 Q9UBT2 2/20 0.45
HPGD P15428 2/20 0.45
XBP1 P17861 1/20 0.45
MPI P34949 1/20 0.45
PABPC1 P11940 2/20 0.45
APAF1 O14727 1/20 0.45
G6PD P11413 1/20 0.45
CACNA1B Q00975 1/20 0.45
APBA1 Q02410 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
MAPK1 P28482 2/20 0.44
POLB P06746 1/20 0.44
CYP2C9 P11712 2/20 0.39

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
SCHEMBL365498 0.93 KMT2A (0.45) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL366343 0.88 ALDH1A1 (0.49) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL364820 0.88 KMT2A (0.46) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL367074 0.87 LMNA (0.39) ALDH1A1KMT2AMAPTMEN1LMNA
SCHEMBL364893 0.86 KMT2A (0.47) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL365602 0.86 ALDH1A1 (0.41) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL364827 0.85 KMT2A (0.48) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL367541 0.84 PSEN1 (0.46) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL366979 0.83 KMT2A (0.45) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL364733 0.81 KMT2A (0.56) ALDH1A1KMT2AKDM4EMAPTMEN1

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-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed