SCHEMBL28474643

SCHEMBL28474643

COC(=O)C1=CC=CC=NC=N1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 3/20 0.33
XDH P47989 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
NFKB1 P19838 1/20 0.33
GFER P55789 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
FUT7 Q11130 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA12 O43570 4/20 0.32
CA1 P00915 4/20 0.32
CA2 P00918 4/20 0.32
CA7 P43166 4/20 0.32
CA9 Q16790 4/20 0.32
CA14 Q9ULX7 4/20 0.32
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL29065453 0.82 NPSR1 (0.38) NPSR1KDM4EXDHTDP1LMNA
SCHEMBL23833210 0.79
SCHEMBL31435414 0.74 NPSR1 (0.34) NPSR1KDM4EXDHTDP1LMNA
SCHEMBL29065452 0.73 NPSR1 (0.44) NPSR1KDM4EXDHTDP1LMNA
SCHEMBL29065451 0.72 NPSR1 (0.35) NPSR1KDM4EXDHTDP1LMNA
SCHEMBL30415854 0.70 NPSR1 (0.34) NPSR1KDM4ETDP1CA12CA1
SCHEMBL7388925 0.69 NPSR1 (0.33) NPSR1KDM4EALDH1A1TSHR
SCHEMBL7388927 0.69 NPSR1 (0.33) NPSR1KDM4EALDH1A1TSHR
SCHEMBL28296127 0.67 NPSR1 (0.34) NPSR1KDM4EXDHTDP1LMNA
SCHEMBL6198951 0.66

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
CN-117126231-A Peptoid STAT protein degradation agent, composition and application thereof 杭州和正医药有限公司 2023-11-28 CN disclosed
CN-116490069-A STAT degradation agent and application thereof 凯麦拉医疗公司 2023-07-25 CN disclosed
CN-115776891-A STAT degradants and uses thereof 凯麦拉医疗公司 2023-03-10 CN disclosed
CN-107709305-B Novel compound 葛兰素史克知识产权开发有限公司 2020-09-29 CN disclosed