SCHEMBL2949020

SCHEMBL2949020

[O-][N+]1(CCN2CCNCC2)CCNC1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CXCR4 P61073 2/20 0.37
HSD17B10 Q99714 1/20 0.34
SIGMAR1 Q99720 2/20 0.33
RAD52 P43351 1/20 0.33
KCNJ1 P48048 1/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL260097 0.75
SCHEMBL8975017 0.71
SCHEMBL365799 0.71
SCHEMBL367450 0.71
SCHEMBL11593405 0.71
SCHEMBL7618569 0.70 CXCR4 (0.50) POLBSMN1; SMN2CXCR4HSD17B10SIGMAR1
SCHEMBL5337467 0.69
SCHEMBL237512 0.68 POLB (0.59) POLBSMN1; SMN2CXCR4HSD17B10SIGMAR1
SCHEMBL11594967 0.68
SCHEMBL3513744 0.68

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-7750113-B2 Supramolecular polymers ARKEMA FRANCE (FR) 2010-07-06 US disclosed
US-20080167442-A1 SUPRAMOLECULAR POLYMERS ARKEMA FRANCE (FR) 2008-07-10 US disclosed
US-7348397-B2 Supramolecular polymers ARKEMA FRANCE (FR) 2008-03-25 US disclosed
US-7250487-B2 Supramolecular polymers ARKEMA FRANCE (FR) 2007-07-31 US disclosed
US-20070123694-A1 Supramolecular polymers TOURNILHAC FRANCOIS-GENES 2007-05-31 US disclosed
EP-1465930-B1 SUPRAMOLECULAR POLYMERS ARKEMA (FR) 2006-05-03 EP disclosed
US-20050148760-A1 Supramolecular polymers ARKEMA FRANCE (FR) 2005-07-07 US disclosed
EP-1465930-A2 SUPRAMOLECULAR POLYMERS ARKEMA (FR) 2004-10-13 EP disclosed
WO-2003059964-A2 SUPRAMOLECULAR POLYMERS ATOFINA (FR) 2003-07-24 WO disclosed