SCHEMBL3169796

SCHEMBL3169796

O=C(O)N1CCCC2CCCC21

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
DPP7 Q9UHL4 1/20 0.44
POLB P06746 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
HSD11B1 P28845 7/20 0.41
HSD17B1 P14061 1/20 0.41
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
CNR2 P34972 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
ACE P12821 2/20 0.36
L3MBTL3 Q96JM7 1/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 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
SCHEMBL2824467 0.96 NPC1 (0.56) NPC1RAB9ASMN1; SMN2DPP7POLB
SCHEMBL10752905 0.91 DPP7 (0.51) NPC1RAB9ASMN1; SMN2DPP7POLB
SCHEMBL10591026 0.91 DPP7 (0.51) NPC1RAB9ASMN1; SMN2DPP7POLB
SCHEMBL385345 0.87 NPC1 (0.51) NPC1RAB9ASMN1; SMN2DPP7POLB
SCHEMBL1419834 0.87 NPC1 (0.47) NPC1RAB9ASMN1; SMN2DPP7POLB
SCHEMBL4445192 0.87 NPC1 (0.51) NPC1RAB9ASMN1; SMN2DPP7POLB
SCHEMBL13254845 0.87 NPC1 (0.51) NPC1RAB9ASMN1; SMN2DPP7POLB
SCHEMBL10757334 0.85 NPC1 (0.50) NPC1RAB9ASMN1; SMN2DPP7POLB
SCHEMBL14740663 0.84 NPC1 (0.45) NPC1RAB9ASMN1; SMN2DPP7POLB
SCHEMBL19974288 0.84 NPC1 (0.43) NPC1RAB9ASMN1; SMN2DPP7POLB

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4735440-A1 KRAS INHIBITORS Bristol-Myers Squibb Company (US) 2026-05-06 EP disclosed
EP-4735439-A1 KRAS INHIBITORS Bristol-Myers Squibb Company (US) 2026-05-06 EP disclosed
WO-2025006962-A1 KRAS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-01-02 WO disclosed
WO-2025006967-A1 KRAS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-01-02 WO disclosed
EP-1817109-B1 MIXED-MODAL ANION-EXCHANGE TYPE SEPARATION MATERIAL MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed
US-7648636-B2 A chromatographic support including an immobilized ligand which combines an anion-exchange domain comprising an oligocyclic aza compound with endocyclic nitrogen and a non-ionic, second binding domain to allow adjustment of the overall hydrophobicity/hydrophilicity; separation; purification; peptides MERCK PATENT GMBH (DE) 2010-01-19 US disclosed
US-20080164211-A1 Mixed-Modal Anion-Exchanged Type Separation Material MERCK PATENT GMBH (DE) 2008-07-10 US disclosed
EP-1817109-A1 MIXED-MODAL ANION-EXCHANGE TYPE SEPARATION MATERIAL Merck Patent GmbH (DE) 2007-08-15 EP disclosed
EP-1693108-A1 Mixed-modal anion-exchange type separation material MERCK PATENT GmbH (DE) 2006-08-23 EP disclosed
WO-2006058623-A1 MIXED-MODAL ANION-EXCHANGE TYPE SEPARATION MATERIAL MERCK PATENT GMBH (DE) 2006-06-08 WO disclosed