SCHEMBL3169477

SCHEMBL3169477

C=C(C)C(=O)NCCC(O)N(C)C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA4 P43681 1/20 0.38
TGFBR1 P36897 1/20 0.34
ALDH1A1 P00352 1/20 0.33
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
ANPEP P15144 2/20 0.32
RNPEP Q9H4A4 2/20 0.32
DNPEP Q9ULA0 1/20 0.32
GAA P10253 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL28191169 0.83 CHRNB2 (0.39) CHRNB2CHRNB4CHRNA4TGFBR1ANPEP
SCHEMBL1903516 0.81 CHRNB2 (0.59) CHRNB2CHRNB4CHRNA4TGFBR1ANPEP
SCHEMBL98539 0.80 TGFBR1 (0.38) CHRNB2CHRNB4CHRNA4TGFBR1ALDH1A1
SCHEMBL27851633 0.80 CHRNB2 (0.37) CHRNB2CHRNB4CHRNA4TGFBR1ANPEP
SCHEMBL316224 0.79 TGFBR1 (0.41) TGFBR1ALDH1A1USP2TSHRRAB9A
SCHEMBL157717 0.79 ALDH1A1 (0.45) CHRNB2CHRNB4CHRNA4TGFBR1ALDH1A1
Ammonia Solution, Strong SCHEMBL28096709 0.79 TGFBR1 (0.37) TGFBR1ALDH1A1ANPEPRNPEPDNPEP
SCHEMBL3235398 0.76 ANPEP (0.52) TGFBR1TSHRANPEPRNPEPDNPEP
SCHEMBL7757017 0.76 TGFBR1 (0.35) TGFBR1ALDH1A1USP2TSHRANPEP
SCHEMBL18141154 0.76 TGFBR1 (0.43) TGFBR1ALDH1A1ANPEPRNPEPDNPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0910594-B1 PROCESS FOR THE PREPARATION OF AQUEOUS DISPERSION POLYMERS BETZDEARBORN INC (US) 2003-04-02 EP claimed
EP-2623975-B1 Stable hemoglobin A1c and glucose measurement method SEKISUI CHEMICAL CO LTD (JP) 2016-02-03 EP disclosed
US-9017536-B2 Hemoglobin measurement method and electrophoresis apparatus SEKISUI CHEMICAL CO., LTD. (JP) 2015-04-28 US disclosed
EP-2105735-B1 STABLE HEMOGLOBIN A1c MEASUREMENT METHOD AND ELECTROPHORESIS APPARATUS SEKISUI CHEMICAL CO LTD (JP) 2014-11-26 EP disclosed
EP-2623975-A2 Hemoglobin and glucose measurement method and electrophoresis apparatus Sekisui Chemical Co., Ltd. (JP) 2013-08-07 EP disclosed
US-20100006436-A1 HEMOGLOBIN MEASUREMENT METHOD AND ELECTROPHORESIS APPARATUS SEKISUI CHEMICAL , CO., LTD. 2010-01-14 US disclosed
EP-2105735-A1 HEMOGLOBIN MEASUREMENT METHOD AND ELECTROPHORESIS APPARATUS Sekisui Chemical Co., Ltd. (JP) 2009-09-30 EP disclosed