SCHEMBL18744693

SCHEMBL18744693

CC(=O)c1ccc(C(C)=O)[nH]1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.36
ALOX15 P16050 1/20 0.36
NFKB1 P19838 1/20 0.36
BLM P54132 1/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 3/20 0.35
KDM4E B2RXH2 2/20 0.35
USP2 O75604 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
CSNK1A1 P48729 1/20 0.33
CSNK1D P48730 1/20 0.33
CLK2 P49760 1/20 0.33
CSNK1G1 Q9HCP0 1/20 0.33

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
SCHEMBL17195442 0.89 KDM4E (0.48) SMN1; SMN2ALOX15NFKB1BLMHPGD
SCHEMBL13261240 0.84
SCHEMBL14337518 0.83 BRD4 (0.31) BRD4
SCHEMBL4676785 0.82
SCHEMBL22641025 0.82
SCHEMBL15003905 0.77 HSD17B1 (0.30) HSD17B1
SCHEMBL1075141 0.77 AR (0.35) THRBGAAMAPTLMNAKMT2A
SCHEMBL20206904 0.75 MMP1 (0.56)
SCHEMBL13872418 0.75 SMN1; SMN2 (0.61) SMN1; SMN2ALOX15NFKB1BLMHPGD
SCHEMBL16012524 0.73 THRB (0.37) SMN1; SMN2THRBMAPTLMNACYP3A4

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1247492-C Cobalt catalyst composition for ethylene oligomerization and application thereof CHINA NAT PETROLEUM CORP (CN) 2006-03-29 CN claimed
CN-1166721-C Method for preparing polyquinoxaline comprising pyrrole structural unit 中国科学院长春应用化学研究所 2004-09-15 CN claimed
CN-1405207-A Method for preparing polyquinoxaline comprising pyrrole structural unit CHANGCHUN APPLIED CHEMISTRY (CN) 2003-03-26 CN claimed
WO-2023079362-A1 PROCESSABLE COMPOSITIONS AND USE FOR THE SAME RIPPLE THERAPEUTICS CORPORATION (CA) 2023-05-11 WO disclosed
US-9624520-B2 Biosynthetically generated pyrroline-carboxy-lysine and site specific protein modifications via chemical derivatization of pyrroline-carboxy-lysine and pyrrolysine residues NOVARTIS AG (CH) 2017-04-18 US disclosed
CN-1166721-C Method for preparing polyquinoxaline comprising pyrrole structural unit 中国科学院长春应用化学研究所 2004-09-15 CN disclosed
CN-1405207-A Method for preparing polyquinoxaline comprising pyrrole structural unit CHANGCHUN APPLIED CHEMISTRY (CN) 2003-03-26 CN disclosed