SCHEMBL7758804

SCHEMBL7758804

CCC=CCn1c(Oc2cc(C)cc(C)c2)c(CC)c(=O)[nH]c1=O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TK1 P04183 3/20 0.32
DRD1 P21728 3/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
MAPT P10636 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
SCHEMBL7758798 1.00 SMN1; SMN2 (0.35) SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7757642 0.91 SMN1; SMN2 (0.33) SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7757638 0.91 SMN1; SMN2 (0.33) SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7756730 0.91 SMN1; SMN2 (0.35) SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7759888 0.91 SMN1; SMN2 (0.35) SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7756725 0.91 SMN1; SMN2 (0.35) SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6087276 0.87 SMN1; SMN2 (0.39) SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7757625 0.85 TNF (0.35) SMN1; SMN2PDE3BPDE3AMEN1KMT2A
SCHEMBL7757681 0.85 TP53 (0.35) SMN1; SMN2KDM4EALDH1A1TK1KMT2A
SCHEMBL7757668 0.85 TP53 (0.35) SMN1; SMN2KDM4EALDH1A1TK1KMT2A

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