SCHEMBL1969312

SCHEMBL1969312

CCN1CCNCCN(Cn2cccn2)CC1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.33
TLR7 Q9NYK1 1/20 0.33
SIGMAR1 Q99720 1/20 0.32
CHRNA7 P36544 1/20 0.32
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 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
SCHEMBL6204930 0.90 SIGMAR1 (0.35) SIGMAR1LMNAL3MBTL1
SCHEMBL1332399 0.90 CHRNA7 (0.37) AURKACHRNA7L3MBTL1
SCHEMBL3381592 0.83 SOD3 (0.47) SIGMAR1LMNA
SCHEMBL7587812 0.82 FDPS (0.38) AURKALMNAL3MBTL1BRD4
SCHEMBL5556736 0.82 FDPS (0.38) AURKALMNAL3MBTL1BRD4
SCHEMBL17305901 0.82 FDPS (0.38) AURKALMNAL3MBTL1BRD4
SCHEMBL825324 0.78 CHRNA7 (0.34) CHRNA7BRD4CREBBP
SCHEMBL22348888 0.76 PDE4A (0.40) TLR7SIGMAR1CHRNA7LMNAPDE4A
SCHEMBL4841885 0.76 KDM1A (0.41) SIGMAR1L3MBTL1BRD4CREBBP
SCHEMBL8607491 0.75 FDPS (0.36) AURKAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2038356-B8 LIQUID HARDENING UNILEVER PLC (GB) 2011-06-22 EP claimed
EP-2038356-A1 LIQUID HARDENING Unilever PLC (GB) 2009-03-25 EP claimed
WO-2008003652-A1 LIQUID HARDENING UNILEVER PLC (GB) 2008-01-10 WO claimed
WO-2010006861-A1 A PROCESS FOR TREATING STAINS ON FABRIC UNILEVER PLC (GB) 2010-01-21 WO disclosed
EP-1259522-B1 LIGAND AND COMPLEX FOR CATALYTICALLY BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2003-09-10 EP disclosed
US-6610641-B2 Transition metal complex UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-08-26 US disclosed
EP-1259522-A1 LIGAND AND COMPLEX FOR CATALYTICALLY BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2002-11-27 EP disclosed
EP-1208186-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2002-05-29 EP disclosed
US-20020010120-A1 Composition and method for bleaching a substrate UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-01-24 US disclosed
WO-2001064697-A1 LIGAND AND COMPLEX FOR CATALYTICALLY BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2001-09-07 WO disclosed
WO-2001016270-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2001-03-08 WO disclosed