SCHEMBL17338273

SCHEMBL17338273

CC(C)(C)OC(=O)N1CC(n2c(CCN)nc3cccc(Cl)c3c2=O)C1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.40
▸ IL1B P01584 3/20 0.40
▸ P2RX7 Q99572 3/20 0.40
▸ PIK3CD O00329 3/20 0.39
▸ OPRM1 P35372 3/20 0.38
▸ OGFRL1 Q5TC84 3/20 0.38
▸ OPRK1 P41145 2/20 0.38
▸ OPRD1 P41143 2/20 0.38
▸ KCNK3 O14649 2/20 0.38
▸ KCNK9 Q9NPC2 2/20 0.38
▸ PIK3CA P42336 3/20 0.37
▸ P2RX3 P56373 1/20 0.37
▸ STS P08842 1/20 0.37
▸ PARP1 P09874 1/20 0.36
▸ TNKS2 Q9H2K2 1/20 0.36
▸ PARP2 Q9UGN5 1/20 0.36
▸ PIK3R2 O00459 2/20 0.35
▸ PIK3CG P48736 1/20 0.35
▸ SCN9A Q15858 1/20 0.35

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
SCHEMBL17338395 0.93 IL1B (0.43) IL1BP2RX7PIK3CDOPRM1OGFRL1
SCHEMBL17338193 0.91 BTK (0.44) PDE10AIL1BP2RX7PIK3CDOPRM1
SCHEMBL17338223 0.91 OPRM1 (0.44) IL1BP2RX7PIK3CDOPRM1OGFRL1
SCHEMBL17338184 0.86 OPRM1 (0.44) IL1BP2RX7PIK3CDOPRM1OGFRL1
SCHEMBL17330844 0.82 PIK3CD (0.45) IL1BP2RX7PIK3CDOPRM1OGFRL1
SCHEMBL17330842 0.82 PIK3CD (0.45) IL1BP2RX7PIK3CDOPRM1OGFRL1
SCHEMBL17338397 0.81 POLB (0.41) PDE10APIK3CDSTSPARP1TNKS2
SCHEMBL17338161 0.81 PIK3CD (0.47) PIK3CDOPRM1OGFRL1OPRK1OPRD1
SCHEMBL17338255 0.80 KEAP1 (0.38) PDE10AIL1BP2RX7OPRM1OGFRL1
SCHEMBL17262976 0.80 PIK3CD (0.44) PIK3CDPIK3CAPIK3R2PIK3CG

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
EP-3154958-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS Gilead Sciences, Inc. (US) 2017-04-19 — — EP disclosed
WO-2015191752-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. (US) 2015-12-17 — — WO disclosed
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