SCHEMBL825251

SCHEMBL825251

Cc1cccnc1CC(N)C(N)(Cc1ncccc1C)Cc1ncccc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38
CXCR4 P61073 3/20 0.34
PLAU P00749 1/20 0.33
MAOA P21397 2/20 0.32
MAOB P27338 1/20 0.32
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SSTR4 P31391 1/20 0.31
DAO P14920 1/20 0.31
ADORA2A P29274 3/20 0.30
ADORA1 P30542 2/20 0.30
SCN4A P35499 3/20 0.30
LMNA P02545 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
TSHR P16473 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
SCHEMBL6203850 0.79 GABRA1 (0.31) L3MBTL1LMNA
SCHEMBL7140521 0.78 NOS3 (0.47) NOS3NOS1NOS2CXCR4PLAU
SCHEMBL28450031 0.76 NOS3 (0.45) NOS3NOS1NOS2CXCR4PLAU
SCHEMBL19214826 0.76 NOS3 (0.45) NOS3NOS1NOS2CXCR4PLAU
SCHEMBL11196155 0.75 NOS3 (0.44) NOS3NOS1NOS2CXCR4PLAU
SCHEMBL20031862 0.73 NOS3 (0.42) NOS3NOS1NOS2CXCR4PLAU
SCHEMBL18160810 0.73 NOS3 (0.42) NOS3NOS1NOS2CXCR4PLAU
SCHEMBL825269 0.73 NOS3 (0.42) NOS3NOS1NOS2CXCR4PLAU
SCHEMBL2084776 0.73 CXCR4 (0.38) NOS3NOS1NOS2CXCR4PLAU
SCHEMBL19214821 0.72 NOS3 (0.41) NOS3NOS1NOS2CXCR4PLAU

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1456337-A1 SUPPORT-FIXED BLEACHING CATALYST COMPLEX COMPOUNDS SUITABLE AS CATALYSTS FOR PEROXIDE COMPOUNDS Henkel Kommanditgesellschaft auf Aktien (DE) 2004-09-15 EP claimed
WO-2003054128-A1 SUPPORT-FIXED BLEACHING CATALYST COMPLEX COMPOUNDS SUITABLE AS CATALYSTS FOR PEROXIDE COMPOUNDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-07-03 WO claimed
EP-1129170-A1 BLEACH AND OXIDATION CATALYST UNILEVER PLC (GB) 2001-09-05 EP claimed
WO-2000027976-A1 BLEACH AND OXIDATION CATALYST UNILEVER PLC (GB) 2000-05-18 WO claimed
EP-2582744-B1 ACCELERATOR SOLUTION AND PROCESS FOR CURING CURABLE RESINS AKZO NOBEL CHEMICALS INT BV (NL) 2014-03-26 EP disclosed
EP-2582744-A1 ACCELERATOR SOLUTION AND PROCESS FOR CURING CURABLE RESINS Akzo Nobel Chemicals International B.V. (NL) 2013-04-24 EP disclosed
WO-2011157673-A1 ACCELERATOR SOLUTION AND PROCESS FOR CURING CURABLE RESINS AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2011-12-22 WO disclosed
EP-2038356-B8 LIQUID HARDENING UNILEVER PLC (GB) 2011-06-22 EP disclosed
EP-2038356-A1 LIQUID HARDENING Unilever PLC (GB) 2009-03-25 EP disclosed
EP-1885830-A2 DETERGENT COMPOSITIONS AND THEIR USE Unilever PLC (GB) 2008-02-13 EP disclosed
WO-2008003652-A1 LIQUID HARDENING UNILEVER PLC (GB) 2008-01-10 WO disclosed
WO-2006128525-A2 DETERGENT COMPOSITIONS AND THEIR USE UNILEVER PLC (GB) 2006-12-07 WO disclosed
EP-1129170-A1 BLEACH AND OXIDATION CATALYST UNILEVER PLC (GB) 2001-09-05 EP disclosed
EP-1109884-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2001-06-27 EP disclosed
EP-1109965-A1 METHOD OF TREATING A TEXTILE UNILEVER PLC (GB) 2001-06-27 EP disclosed
WO-2000060043-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2000-10-12 WO disclosed
WO-2000027976-A1 BLEACH AND OXIDATION CATALYST UNILEVER PLC (GB) 2000-05-18 WO disclosed
WO-2000027975-A1 DETERGENT BLEACHING COMPOSITION UNILEVER PLC (GB) 2000-05-18 WO disclosed
WO-2000012667-A1 COMPOSITION AND METHOD FOR BLEACHING A SUBSTRATE UNILEVER PLC (GB) 2000-03-09 WO disclosed
WO-2000012808-A1 METHOD OF TREATING A TEXTILE UNILEVER PLC (GB) 2000-03-09 WO disclosed