SCHEMBL7757624

SCHEMBL7757624

C=CCn1c(Cc2cc(C)cc(C)c2)c(CC)c(=O)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 4/20 0.36
ALDH1A1 P00352 7/20 0.36
MAPK1 P28482 3/20 0.36
TP53 P04637 2/20 0.36
TSHR P16473 1/20 0.36
KDM4E B2RXH2 4/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 3/20 0.35
RAB9A P51151 1/20 0.35
NCOA1 Q15788 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
THRB P10828 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
XBP1 P17861 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
BRD4 O60885 1/20 0.35
BRDT Q58F21 1/20 0.35
CYP1A2 P05177 1/20 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
SCHEMBL9119053 0.93 SMN1; SMN2 (0.35) SMN1; SMN2KMT2ALMNAALDH1A1MAPK1
SCHEMBL9119058 0.93 SMN1; SMN2 (0.35) SMN1; SMN2KMT2ALMNAALDH1A1MAPK1
SCHEMBL7756600 0.86 ALDH1A1 (0.37) SMN1; SMN2KMT2ALMNAALDH1A1MAPK1
SCHEMBL7756611 0.86 ALDH1A1 (0.37) SMN1; SMN2KMT2ALMNAALDH1A1MAPK1
SCHEMBL7756666 0.85 TPH1 (0.37) SMN1; SMN2KMT2AALDH1A1KDM4EHPGD
SCHEMBL7260719 0.85 MEN1 (0.35) SMN1; SMN2KMT2ALMNAALDH1A1MAPK1
SCHEMBL7759889 0.85 LMNA (0.47) KMT2ALMNAALDH1A1KDM4EMAPT
SCHEMBL7758263 0.82 TP53 (0.36) SMN1; SMN2KMT2ALMNAALDH1A1TP53
SCHEMBL7758268 0.82 TP53 (0.36) SMN1; SMN2KMT2ALMNAALDH1A1TP53
SCHEMBL2107018 0.80 SMN1; SMN2 (0.36) SMN1; SMN2KMT2AALDH1A1KDM4EHPGD

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 2 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