SCHEMBL31572369

SCHEMBL31572369

COC(=O)Cc1ccc(Nc2nc(Cl)nc3c2[S+]([O-])CC3)cc1F

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 7/20 0.40
▸ PDE4D Q08499 7/20 0.40
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ IDH1 O75874 3/20 0.34
▸ EGFR P00533 3/20 0.33
▸ SYK P43405 2/20 0.33
▸ TYK2 P29597 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ RORC P51449 1/20 0.32
▸ CYP26A1 O43174 1/20 0.32
▸ KDR P35968 1/20 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
SCHEMBL31572399 0.84 BCL6 (0.39) PDE4BPDE4DMEN1KMT2AMAPT
SCHEMBL31572385 0.80 GPR119 (0.35) PDE4BPDE4DMAPTEGFR
SCHEMBL31572377 0.79 PDE4B (0.44) PDE4BPDE4DMEN1KMT2AMAPT
SCHEMBL31572383 0.79 TRPV1 (0.33) PDE4BPDE4DMEN1KMT2AMAPT
SCHEMBL31491377 0.79 SYK (0.47) MEN1KMT2AMAPTSYKALDH1A1
SCHEMBL31572368 0.78 PDE4B (0.50) PDE4BPDE4DMEN1KMT2AMAPT
SCHEMBL30785597 0.76 MAPT (0.43) MEN1KMT2AMAPTSYKTYK2
SCHEMBL31083964 0.76 LMNA (0.47) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL31572374 0.74 PDE4B (0.37) PDE4BPDE4D
SCHEMBL4063171 0.73 KDR (0.40) KMT2AEGFRALDH1A1POLBKDR

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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