SCHEMBL8624752

SCHEMBL8624752

CCOP(=O)(OCC)C(CC)Nc1ccc2ccccc2c1N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.47
KDM4E B2RXH2 3/20 0.47
LMNA P02545 1/20 0.47
ALDH1A1 P00352 2/20 0.42
THRB P10828 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
POLB P06746 1/20 0.38
NCEH1 Q6PIU2 1/20 0.37
EPHX2 P34913 1/20 0.36
NR1I2 O75469 1/20 0.35
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
MMP14 P50281 1/20 0.34
CA14 Q9ULX7 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL8621614 0.91 HPGD (0.44) HPGDKDM4ELMNAALDH1A1THRB
SCHEMBL8623668 0.87 HPGD (0.47) HPGDKDM4ELMNAALDH1A1THRB
SCHEMBL8617880 0.84 KDM4E (0.53) HPGDKDM4ELMNAPOLBEPHX2
SCHEMBL9038096 0.83 KDM4E (0.41) HPGDKDM4ELMNAEPHX2MAPT
SCHEMBL8622260 0.81 HSP90AA1 (0.45) HPGDKDM4ELMNAALDH1A1THRB
SCHEMBL8624756 0.80 KDM4E (0.36) HPGDKDM4ELMNAALDH1A1THRB
SCHEMBL8619480 0.76 HPGD (0.49) HPGDKDM4ELMNAALDH1A1THRB
SCHEMBL8621618 0.75 KDM4E (0.35) HPGDKDM4ELMNAALDH1A1L3MBTL1
SCHEMBL8623672 0.74 KDM4E (0.38) HPGDKDM4ELMNAALDH1A1THRB
SCHEMBL8623627 0.73 HSP90AA1 (0.42) HPGDKDM4ELMNAALDH1A1THRB

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