SCHEMBL30898516

SCHEMBL30898516

CCOC(=O)c1cnc(Cl)cc1-c1ccccc1OC

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
DPP4 P27487 1/20 0.46

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
SCHEMBL22717380 1.00 KDM4E (0.50) KDM4EALDH1A1LMNATP53MAPT
SCHEMBL31167806 0.87 DPP4 (0.50) DPP4
SCHEMBL22717275 0.87 POLB (0.48) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL29574145 0.86 ALDH1A1 (0.47) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL22717493 0.86 ALDH1A1 (0.47) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL5778875 0.86 ALDH1A1 (0.53) KDM4EALDH1A1LMNATP53MAPT
SCHEMBL22717735 0.85 DPP4 (0.49) ALDH1A1LMNATP53MAPTMEN1
SCHEMBL22717257 0.84 MAPT (0.47) LMNATP53MAPTMEN1KMT2A
SCHEMBL22717520 0.84 GABRP (0.51) LMNATP53MAPTMEN1KMT2A
SCHEMBL22717321 0.84 MAPT (0.47) LMNATP53MAPTMEN1KMT2A

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-118055930-A Thiadiazole derivative, composition and application thereof 北京丹擎医药科技有限公司 2024-05-17 CN disclosed