SCHEMBL31572374

SCHEMBL31572374

O=C(O)Cc1ccc(Nc2nc(N3CCN(c4ncc(Cl)cn4)CC3)nc3c2[S+]([O-])CC3)cc1F

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 7/20 0.37
▸ PDE4D Q08499 7/20 0.37
▸ GPR119 Q8TDV5 4/20 0.36
▸ KCNH2 Q12809 3/20 0.36
▸ BCL6 P41182 3/20 0.35
▸ TRPV1 Q8NER1 2/20 0.34
▸ ROCK2 O75116 1/20 0.33
▸ ROCK1 Q13464 1/20 0.33
▸ MAPK9 P45984 1/20 0.32
▸ MAPK10 P53779 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
SCHEMBL31572397 0.93 GPR119 (0.35) PDE4BPDE4DGPR119KCNH2BCL6
SCHEMBL31572399 0.92 BCL6 (0.39) PDE4BPDE4DGPR119KCNH2BCL6
SCHEMBL31571853 0.91 GPR119 (0.35) PDE4BPDE4DGPR119KCNH2BCL6
SCHEMBL31571887 0.88 PDE4B (0.36) PDE4BPDE4DGPR119KCNH2TRPV1
SCHEMBL31572385 0.83 GPR119 (0.35) PDE4BPDE4DGPR119KCNH2BCL6
SCHEMBL31572383 0.81 TRPV1 (0.33) PDE4BPDE4DGPR119KCNH2BCL6
SCHEMBL31571849 0.80 PDE4B (0.59) PDE4BPDE4D
SCHEMBL31572369 0.74 PDE4B (0.40) PDE4BPDE4D
SCHEMBL31572367 0.72 PDE4B (0.55) PDE4BPDE4DBCL6
SCHEMBL31571854 0.72 PDE4B (0.55) 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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