SCHEMBL25604635

SCHEMBL25604635

CCOC(=O)Cc1noc2c3c(ccc12)CC(CO)C3

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.38
RECQL P46063 1/20 0.37
ALDH1A1 P00352 4/20 0.36
MAPK1 P28482 1/20 0.32
POLB P06746 1/20 0.32
SLC6A4 P31645 2/20 0.31
MIF P14174 1/20 0.31
KDM4E B2RXH2 2/20 0.31
HPGD P15428 2/20 0.31
MAPT P10636 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTR2C P28335 1/20 0.31

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
SCHEMBL25827697 0.84 SMN1; SMN2 (0.36) SMN1; SMN2RECQLALDH1A1MAPK1POLB
SCHEMBL25604491 0.80 SMN1; SMN2 (0.41) SMN1; SMN2RECQLALDH1A1MAPK1POLB
SCHEMBL25604265 0.76 L3MBTL1 (0.37) SMN1; SMN2RECQLALDH1A1MEN1KMT2A
SCHEMBL25826024 0.76 L3MBTL1 (0.37) SMN1; SMN2RECQLALDH1A1MEN1KMT2A
SCHEMBL25825902 0.75 L3MBTL1 (0.39) SMN1; SMN2RECQLALDH1A1MAPK1MEN1
SCHEMBL25604356 0.74 ESR2 (0.39) SMN1; SMN2RECQLALDH1A1POLBMEN1
SCHEMBL11791757 0.73 SMN1; SMN2 (0.44) SMN1; SMN2RECQLALDH1A1MAPK1POLB
SCHEMBL25604199 0.73 ESR2 (0.43) SMN1; SMN2RECQLMAPK1MAPT
SCHEMBL25825841 0.72 L3MBTL1 (0.37) SMN1; SMN2RECQLALDH1A1POLBMEN1
SCHEMBL31443713 0.72 SMN1; SMN2 (0.42) SMN1; SMN2RECQLALDH1A1MAPK1POLB

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
WO-2023125944-A1 COMPOUND CONTAINING HETEROCYCLIC RING 正大天晴药业集团股份有限公司 2023-07-06 WO disclosed
WO-2023088406-A1 FUSED IMIDE DERIVATIVE 正大天晴药业集团股份有限公司 2023-05-25 WO disclosed