SCHEMBL7759949

SCHEMBL7759949

CCc1c(Sc2cc(C)cc(C)c2)n(CC=CC(=O)OC)c(=O)[nH]c1=O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TNF P01375 1/20 0.34
ADORA3 P0DMS8 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.30
ADORA2B P29275 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
SCHEMBL7756651 0.89 MEN1 (0.32) MEN1KMT2ATDP1SMN1; SMN2
SCHEMBL7759903 0.85 TNF (0.34) MEN1KMT2ATDP1TNFADORA3
SCHEMBL7758304 0.84 SMN1; SMN2 (0.33) MEN1KMT2ATDP1SMN1; SMN2
SCHEMBL7758302 0.84 SMN1; SMN2 (0.33) MEN1KMT2ATDP1SMN1; SMN2
SCHEMBL7756702 0.84 SMN1; SMN2 (0.35) MEN1KMT2ATDP1SMN1; SMN2
SCHEMBL7757670 0.84 ALDH1A1 (0.36) MEN1KMT2ATDP1TNFSMN1; SMN2
SCHEMBL7757675 0.84 ALDH1A1 (0.36) MEN1KMT2ATDP1TNFSMN1; SMN2
SCHEMBL7756712 0.84 SMN1; SMN2 (0.35) MEN1KMT2ATDP1SMN1; SMN2
SCHEMBL7757656 0.82 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL7758245 0.81 MEN1 (0.38) MEN1KMT2ATDP1TNFADORA3

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