SCHEMBL31339610

SCHEMBL31339610

COC(=O)c1cn(CCOC(=O)c2ccccc2)c(=O)cc1O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
TSHR P16473 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 5/20 0.43
TDP1 Q9NUW8 1/20 0.42
BRD4 O60885 2/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 2/20 0.41
SLC6A3 Q01959 1/20 0.40
NR4A2 P43354 1/20 0.40
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.39
CNR1 P21554 1/20 0.39

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
SCHEMBL31339611 1.00 SMN1; SMN2 (0.46) SMN1; SMN2TSHRL3MBTL1LMNATDP1
SCHEMBL31339594 0.88 SMN1; SMN2 (0.46) SMN1; SMN2TSHRL3MBTL1LMNATDP1
SCHEMBL31339563 0.86 SLC6A3 (0.50) SMN1; SMN2TSHRL3MBTL1LMNATDP1
SCHEMBL1640291 0.82 CA12 (0.41) SMN1; SMN2TSHRL3MBTL1LMNABRD4
SCHEMBL31339585 0.80 SMN1; SMN2 (0.39) SMN1; SMN2TSHRL3MBTL1LMNATDP1
SCHEMBL31339591 0.79 CA12 (0.44) SMN1; SMN2TSHRL3MBTL1LMNATDP1
SCHEMBL1641959 0.79 KDM4E (0.48) SMN1; SMN2TSHRLMNABRD4MAPT
SCHEMBL30910244 0.75 CNR1 (0.49) TDP1BRD4GAANR4A2CNR1
SCHEMBL17156651 0.74 BAZ2B (0.47) TSHRL3MBTL1LMNAGAAMAPT
SCHEMBL1642110 0.72 HSP90AA1 (0.48) SMN1; SMN2LMNABRD4MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119384422-A Pyridazinopyridone derivatives and uses thereof 四川汇宇制药股份有限公司 2025-01-28 CN disclosed