SCHEMBL3736026

SCHEMBL3736026

C=C(C)C(=O)NCCC(C)CN(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 3/20 0.37
RNPEP Q9H4A4 3/20 0.37
DNPEP Q9ULA0 2/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA4 P43681 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
RAB9A P51151 2/20 0.35
GAA P10253 2/20 0.35
NPC1 O15118 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TGFBR1 P36897 1/20 0.33
KDM4E B2RXH2 2/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
RXFP1 Q9HBX9 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
SCHEMBL8850145 0.85 USP2 (0.36) ANPEPRNPEPDNPEPCHRNB2CHRNB4
SCHEMBL3734949 0.82 GAA (0.44) SMN1; SMN2RAB9AGAANPC1TGFBR1
SCHEMBL3235398 0.81 ANPEP (0.52) ANPEPRNPEPDNPEPSMN1; SMN2RAB9A
SCHEMBL10750333 0.80 ANPEP (0.36) ANPEPRNPEPDNPEPCHRNB2CHRNB4
SCHEMBL1903516 0.79 CHRNB2 (0.59) ANPEPRNPEPDNPEPCHRNB2CHRNB4
SCHEMBL18359022 0.78 GGPS1 (0.41)
SCHEMBL13862893 0.77 TGFBR1 (0.43) ANPEPRNPEPDNPEPCHRNB2CHRNB4
SCHEMBL28191169 0.77 CHRNB2 (0.39) ANPEPRNPEPDNPEPCHRNB2CHRNB4
SCHEMBL20380363 0.76 ANPEP (0.33) ANPEPRNPEPDNPEPSMN1; SMN2RAB9A
SCHEMBL157717 0.76 ALDH1A1 (0.45) ANPEPRNPEPDNPEPCHRNB2CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5523367-A DISPOSABLE PRODUCTS PHILLIPS PETROLEUM COMPANY (US) 1996-06-04 US claimed
EP-1438354-B1 CELLULOSE MATERIAL WITH IMPROVED ABSORBENCY EVONIK STOCKHAUSEN LLC (US) 2010-11-03 EP disclosed
US-7482058-B2 Preparing a slurry of an aqueous solution of pre-superabsorbent polymer and cellulose, filtering and heat treating the slurry; agricultural products, fiber optic cables, power cables, water blocking tapes, insulation, hygiene articles EVONIK STOCKHAUSEN GMBH (DE) 2009-01-27 US disclosed
US-6906131-B2 Preparing slurry from aqueous solution of pre-superabsorbent polymer, which is formed from monomer and cellulose material,filtering and heat treating the slurry to obtain a treated cellulose material having an enhanced absorbency STOCKHAUSEN GMBH & CO. KG (DE) 2005-06-14 US disclosed
US-20050020771-A1 Preparing a slurry of an aqueous solution of pre-superabsorbent polymer and cellulose, filtering and heat treating the slurry; agricultural products, fiber optic cables, power cables, water blocking tapes, insulation, hygiene articles EVONIK SUPERABSORBER GMBH (DE) 2005-01-27 US disclosed
EP-1438354-A1 CELLULOSE MATERIAL WITH IMPROVED ABSORBENCY Stockhausen Inc. (US) 2004-07-21 EP disclosed
WO-2003025054-A1 CELLULOSE MATERIAL WITH IMPROVED ABSORBENCY STOCKHAUSEN INC. (US) 2003-03-27 WO disclosed
US-20030055133-A1 Preparing slurry from aqueous solution of pre-superabsorbent polymer, which is formed from monomer and cellulose material,filtering and heat treating the slurry to obtain a treated cellulose material having an enhanced absorbency EVONIK OPERATIONS GMBH (DE) 2003-03-20 US disclosed
US-5523367-A DISPOSABLE PRODUCTS PHILLIPS PETROLEUM COMPANY (US) 1996-06-04 US disclosed