SCHEMBL8468545

SCHEMBL8468545

NCCCCC(O)CCCCN

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 2/20 0.47
GSR P00390 1/20 0.46
RNPEP Q9H4A4 1/20 0.44
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 1/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
BLM P54132 1/20 0.44
CPB2 Q96IY4 2/20 0.39
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL17695276 0.97 GSR (0.44) NFKB1GSRRNPEPCA12CA1
SCHEMBL154286 0.97 DNM1 (0.50) NFKB1GSRRNPEPCA12CA1
SCHEMBL9812329 0.97 DNM1 (0.50) NFKB1GSRRNPEPCA12CA1
SCHEMBL17695271 0.94 GSR (0.42) NFKB1GSRRNPEPCA12CA1
SCHEMBL28313047 0.94 GSR (0.42) NFKB1GSRRNPEPCA12CA1
SCHEMBL3686332 0.93 GSR (0.40) NFKB1GSRRNPEPCA12CA1
SCHEMBL7196194 0.93 GSR (0.40) NFKB1GSRRNPEPCA12CA1
SCHEMBL20639330 0.91 GSR (0.41) NFKB1GSRRNPEPCA12CA1
SCHEMBL11139600 0.91 DNM1 (0.44) NFKB1GSRRNPEPCA12CA1
SCHEMBL15651696 0.91 DNM1 (0.44) NFKB1GSRRNPEPCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0853644-B1 WATERBORNE POLYOLEFIN ADHESION PROMOTER EASTMAN CHEM CO (US) 1999-11-24 EP disclosed
EP-0853644-A1 WATERBORNE POLYOLEFIN ADHESION PROMOTER EASTMAN CHEMICAL COMPANY (US) 1998-07-22 EP disclosed
WO-1997012935-A1 WATERBORNE POLYOLEFIN ADHESION PROMOTER EASTMAN CHEMICAL COMPANY (US) 1997-04-10 WO disclosed
US-5585192-A EMULSIFYING NON-OXIDIZED, NON-MALEATED, NON-CHLORINATED CRYSTALLINE POLYOLEFINS, NON-CHLORINATED, MALEATED, AMORPHOUS POLYOLEFINS IN PRESENCE OF SURFACTANT, AMINE AND WATER EASTMAN CHEMICAL COMPANY (US) 1996-12-17 US disclosed
US-4097462-A OXIDATIVE COUPLING OF A PHENOL, PRECIPITATION, MANGANESE (II) HYDROXYOXIME CHELATE CATALYST GENERAL ELECTRIC COMPANY (US) 1978-06-27 US disclosed
US-3972851-A Preparation of polyphenylene oxide using a manganese(II) ortho-hydroxyarene-oxime chelate reaction promoter GENERAL ELECTRIC COMPANY (US) 1976-08-03 US disclosed
US-3965069-A Polyphenylene oxide is prepared using a mixture of manganese chelates as a catalyst GENERAL ELECTRIC COMPANY (US) 1976-06-22 US disclosed
US-3956242-A Preparation of polyphenylene oxide using a manganese (II) ω-hydroxyoxime chelate reaction promoter GENERAL ELECTRIC COMPANY (US) 1976-05-11 US disclosed