SCHEMBL2357722

SCHEMBL2357722

NCCCCC(N)CCC(N)CCCCN

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.47
GSR P00390 1/20 0.46
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA3 P07451 2/20 0.44
CA4 P22748 2/20 0.44
CA6 P23280 2/20 0.44
CA5A P35218 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
CA5B Q9Y2D0 2/20 0.44
DNM1 Q05193 2/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
BLM P54132 1/20 0.44
RNPEP Q9H4A4 1/20 0.39
ENPEP Q07075 1/20 0.35
CPB2 Q96IY4 1/20 0.34

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
SCHEMBL11084535 0.97 GSR (0.44) NFKB1GSRCA12CA1CA2
SCHEMBL350694 0.97 NFKB1 (0.50) NFKB1GSRCA12CA1CA2
SCHEMBL349469 0.93 DNM1 (0.53) NFKB1GSRCA12CA1CA2
SCHEMBL20597340 0.93 DNM1 (0.53) NFKB1GSRCA12CA1CA2
SCHEMBL349619 0.93 DNM1 (0.53) NFKB1GSRCA12CA1CA2
SCHEMBL352357 0.93 DNM1 (0.53) NFKB1GSRCA12CA1CA2
SCHEMBL16696692 0.93 DNM1 (0.53) NFKB1GSRCA12CA1CA2
SCHEMBL351414 0.93 NFKB1 (0.47) NFKB1GSRCA12CA1CA2
SCHEMBL350445 0.93 DNM1 (0.53) NFKB1GSRCA12CA1CA2
SCHEMBL351453 0.93 DNM1 (0.53) NFKB1GSRCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105637044-B Cationic water-dilutable binders 湛新奥地利有限公司 2019-03-05 CN disclosed
CN-105637043-B The dilutable binder of cationic water 湛新奥地利有限公司 2018-09-11 CN disclosed
EP-2536774-A2 CATIONIC ACRYLIC RESINS Cytec Austria GmbH (AT) 2012-12-26 EP disclosed
WO-2011101460-A2 CATIONIC ACRYLIC RESINS CYTEC AUSTRIA GMBH (AT) 2011-08-25 WO disclosed