SCHEMBL31572388

SCHEMBL31572388

COC(=O)C1(c2ccc(Nc3nc(Cl)nc4c3SCCC4)cc2F)CCC1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 17/20 0.44
▸ PDE4D Q08499 17/20 0.44
▸ SYK P43405 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ BACE1 P56817 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
SCHEMBL31572403 0.89 PDE4B (0.43) PDE4BPDE4DSYK
SCHEMBL31572368 0.79 PDE4B (0.50) PDE4BPDE4DMEN1MAPTKMT2A
SCHEMBL7906240 0.74 MEN1 (0.42) PDE4BPDE4DMEN1MAPTKMT2A
SCHEMBL31572377 0.73 PDE4B (0.44) PDE4BPDE4DMEN1MAPTKMT2A
SCHEMBL31572366 0.73 PDE4B (0.51) PDE4BPDE4DMEN1MAPTKMT2A
SCHEMBL31572380 0.72 PDE4B (0.44) PDE4BPDE4DSYKMAPT
SCHEMBL31571896 0.71 PDE4B (0.48) PDE4BPDE4D
SCHEMBL2271101 0.70 PDE4B (0.41) PDE4BMAPT
SCHEMBL2266566 0.70 PDE4B (0.40) PDE4BMEN1MAPTKMT2A
SCHEMBL31083997 0.69 PDE4B (0.33) PDE4BPDE4D

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
WO-2025092985-A1 PHOSPHODIESTERASE 4B INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 合肥医工医药股份有限公司 2025-05-08 — — WO disclosed
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