SCHEMBL30708580

SCHEMBL30708580

O=S1(=O)CCCc2nc(N3CCC(c4ncc(Cl)cn4)CC3)nc(NC3(CO)CCC3)c21

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 19/20 0.35
▸ PIK3R1 P27986 18/20 0.35
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CB P42338 1/20 0.30
▸ CNR2 P34972 1/20 0.30

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
SCHEMBL14751855 0.82 PIK3CA (0.36) PIK3CAPIK3R1PIK3CDPIK3CB
SCHEMBL30678886 0.81 PIK3R1 (0.34) PIK3CAPIK3R1
SCHEMBL25606380 0.80 PIK3R1 (0.34) PIK3CAPIK3R1
SCHEMBL31084092 0.80 PIK3R1 (0.34) PIK3CAPIK3R1
SCHEMBL31158263 0.80 PIK3R1 (0.34) PIK3CAPIK3R1
SCHEMBL31571886 0.80 HSD11B1 (0.31) —
SCHEMBL30678851 0.80 PIK3R1 (0.33) PIK3CAPIK3R1
SCHEMBL373572 0.79 GRM5 (0.34) PIK3CAPIK3R1
SCHEMBL31571857 0.79 PDE4B (0.30) —
Nerandomilast SCHEMBL14734178 0.79 PIK3R1 (0.34) PIK3CAPIK3R1

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 2 patents. 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
WO-2023241683-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND ACTING AS PDE4B INHIBITOR 武汉人福创新药物研发中心有限公司 2023-12-21 — — WO disclosed
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