SCHEMBL7756583

SCHEMBL7756583

CC=CCn1c(Sc2ccccc2)c(CC)c(=O)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.44
HPGD P15428 5/20 0.44
HSD17B10 Q99714 4/20 0.44
TSHR P16473 4/20 0.44
NOD1 Q9Y239 3/20 0.44
LMNA P02545 4/20 0.41
ALOX15 P16050 3/20 0.41
NOD2 Q9HC29 2/20 0.41
TNF P01375 1/20 0.41
TP53 P04637 1/20 0.41
CXCL8 P10145 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPK1 P28482 3/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 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
SCHEMBL7756577 1.00 ALDH1A1 (0.44) ALDH1A1HPGDHSD17B10TSHRNOD1
SCHEMBL7756652 0.88 LMNA (0.38) ALDH1A1HPGDHSD17B10TSHRNOD1
SCHEMBL7756656 0.88 LMNA (0.38) ALDH1A1HPGDHSD17B10TSHRNOD1
SCHEMBL7757667 0.86 LMNA (0.52) ALDH1A1HPGDTSHRNOD1LMNA
SCHEMBL7759936 0.85 TK1 (0.43) ALDH1A1HPGDHSD17B10TSHRNOD1
SCHEMBL7758853 0.84 LMNA (0.38) ALDH1A1HPGDTSHRLMNAMAPT
SCHEMBL7757675 0.84 ALDH1A1 (0.36) ALDH1A1HPGDHSD17B10TSHRNOD1
SCHEMBL7757670 0.84 ALDH1A1 (0.36) ALDH1A1HPGDHSD17B10TSHRNOD1
SCHEMBL7213295 0.80 ALDH1A1 (0.50) ALDH1A1HPGDTSHRNOD1LMNA
SCHEMBL7756601 0.79 ALDH1A1 (0.37) ALDH1A1HPGDTSHRLMNAPKM

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