SCHEMBL8618907

SCHEMBL8618907

CCOP(=O)(OCC)C(CC)n1c(=O)c(=O)[nH]c2ccc3c(S(N)(=O)=O)cccc3c21

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
CA2 P00918 4/20 0.31
CA12 O43570 3/20 0.31
CA1 P00915 3/20 0.31
CA9 Q16790 3/20 0.31
CDK2 P24941 1/20 0.31
GRM6 O15303 1/20 0.31
GLA P06280 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL9037032 0.90 PTGS2 (0.31) KMT2AKDM4EMEN1ALDH1A1USP2
SCHEMBL8624748 0.90 KMT2A (0.33) KMT2AKDM4EMEN1ALDH1A1USP2
SCHEMBL8617926 0.87 CDK2 (0.35) KMT2AKDM4EMEN1ALDH1A1USP2
SCHEMBL8624187 0.87 PTGS2 (0.35) KMT2AKDM4EMEN1ALDH1A1USP2
SCHEMBL8624317 0.83 KDM4E (0.51) KMT2AKDM4EMEN1ALDH1A1CA2
SCHEMBL8624851 0.80 KMT2A (0.33) KMT2AKDM4EMEN1ALDH1A1USP2
SCHEMBL8616696 0.78 CDK2 (0.37) KMT2AKDM4EMEN1ALDH1A1USP2
SCHEMBL9037631 0.75 KDM4E (0.42) KMT2AKDM4EMEN1ALDH1A1CA2
SCHEMBL8619799 0.75 CDK2 (0.38) KMT2AKDM4EMEN1ALDH1A1USP2
SCHEMBL8619987 0.74 SIRT2 (0.38) LMNATSHRCA2CA12CA1

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
US-5710138-A Benzo f!quinoxalinedione derivatives, their production and use in pharmaceutical agents SCHERING AKTIENGESELLSCHAFT (DE) 1998-01-20 US disclosed
EP-0696289-B1 BENZO[F]QUINOXALINDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN DRUGS SCHERING AG (DE) 1997-03-12 EP disclosed
WO-1994025470-A1 BENZO[F]QUINOXALINDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN DRUGS SCHERING AKTIENGESELLSCHAFT (DE) 1994-11-10 WO disclosed