SCHEMBL7758249

SCHEMBL7758249

CCc1c(Cc2ccccc2)n(C/C=C/c2ccccc2)c(=O)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.39
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 6/20 0.38
MEN1 O00255 2/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 2/20 0.36
DAO P14920 1/20 0.36
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
NOD1 Q9Y239 1/20 0.35
TYMP P19971 1/20 0.35
ALDH3A1 P30838 1/20 0.35
RCE1 Q9Y256 1/20 0.35
TK1 P04183 1/20 0.35

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
SCHEMBL7758254 1.00 LTA4H (0.39) LTA4HKMT2ALMNAKDM4ESMN1; SMN2
SCHEMBL7758263 0.92 TP53 (0.36) KMT2ALMNAKDM4ESMN1; SMN2MAPT
SCHEMBL7758268 0.92 TP53 (0.36) KMT2ALMNAKDM4ESMN1; SMN2MAPT
SCHEMBL7758330 0.88 ALDH1A1 (0.46) KMT2ALMNAKDM4ESMN1; SMN2MAPT
SCHEMBL7758327 0.88 ALDH1A1 (0.46) KMT2ALMNAKDM4ESMN1; SMN2MAPT
SCHEMBL7759889 0.84 LMNA (0.47) KMT2ALMNAKDM4EMAPTALDH1A1
SCHEMBL9009447 0.83 LTA4H (0.39) LTA4HKMT2ALMNAKDM4EMAPT
SCHEMBL7255873 0.79 ALDH1A1 (0.38) KMT2ALMNAKDM4ESMN1; SMN2MAPT
SCHEMBL7756656 0.79 LMNA (0.38) KMT2ALMNAKDM4ESMN1; SMN2MAPT
SCHEMBL7756652 0.79 LMNA (0.38) KMT2ALMNAKDM4ESMN1; SMN2MAPT

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
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
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