SCHEMBL7756702

SCHEMBL7756702

CC/C=C/Cn1c(Sc2cc(C)cc(C)c2)c(CC)c(=O)[nH]c1=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
PKM P14618 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
NOTUM Q6P988 1/20 0.30
TK1 P04183 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
SCHEMBL7756712 1.00 SMN1; SMN2 (0.35) SMN1; SMN2PKMMEN1KMT2ATDP1
SCHEMBL7757656 0.91 SMN1; SMN2 (0.33) SMN1; SMN2PKM
SCHEMBL7758304 0.91 SMN1; SMN2 (0.33) SMN1; SMN2PKMMEN1KMT2ATDP1
SCHEMBL7758302 0.91 SMN1; SMN2 (0.33) SMN1; SMN2PKMMEN1KMT2ATDP1
SCHEMBL7757658 0.91 SMN1; SMN2 (0.33) SMN1; SMN2PKM
SCHEMBL7757675 0.91 ALDH1A1 (0.36) SMN1; SMN2PKMMEN1KMT2ATDP1
SCHEMBL7757670 0.91 ALDH1A1 (0.36) SMN1; SMN2PKMMEN1KMT2ATDP1
SCHEMBL7758317 0.87 KMT2A (0.39) SMN1; SMN2PKMMEN1KMT2AKDM4E
SCHEMBL7756651 0.86 MEN1 (0.32) SMN1; SMN2PKMMEN1KMT2ATDP1
SCHEMBL8580011 0.85 TP53 (0.37) SMN1; SMN2MEN1KMT2AKDM4EALDH1A1

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