SCHEMBL7758274

SCHEMBL7758274

CCc1c(C(=O)c2cc(C)cc(C)c2)n(CC=C(C)C)c(=O)[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TPH1 P17752 2/20 0.37
TPH2 Q8IWU9 2/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
ALDH1A1 P00352 3/20 0.32
MAPT P10636 3/20 0.32
KDM4E B2RXH2 3/20 0.31
PARP1 P09874 1/20 0.31
PARP2 Q9UGN5 1/20 0.31
MAPK1 P28482 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL6087554 0.87 ALDH1A1 (0.40) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7757700 0.86 KMT2A (0.36) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7757663 0.86 KMT2A (0.36) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7759930 0.86 KMT2A (0.36) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7759929 0.86 KMT2A (0.36) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7757655 0.86 KMT2A (0.36) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL7260730 0.85 MEN1 (0.36) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL6087754 0.85 KMT2A (0.39) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1
SCHEMBL12752168 0.85 KMT2A (0.40) TPH1TPH2KMT2AMEN1TDP1
SCHEMBL7758326 0.85 KMT2A (0.36) KMT2AMEN1TDP1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0736015-B1 ANTIVIRAL 2,4-PYRIMIDINDIONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RES INST CHEM TECH (KR) 2001-03-07 EP disclosed
US-5747500-A VIRICIDES FOR AIDS KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1998-05-05 US disclosed
EP-0736015-A1 NOVEL ANTIVIRAL 2,4-PYRIMIDINEDIONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1996-10-09 EP disclosed
WO-1995018109-A1 NOVEL ANTIVIRAL 2,4-PYRIMIDINEDIONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-07-06 WO disclosed