SCHEMBL3401142

SCHEMBL3401142

C=Cc1[nH]c(CC)nc1C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ADORA1 P30542 4/20 0.38
ADORA3 P0DMS8 3/20 0.38
ADORA2A P29274 2/20 0.38
DDAH1 O94760 1/20 0.33
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
TNKS2 Q9H2K2 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
SCHEMBL19091935 0.84 MAPK1 (0.38)
SCHEMBL811725 0.79 TP53 (0.41) TP53L3MBTL1ADORA1ADORA3ADORA2A
SCHEMBL6134852 0.78 GAA (0.38) TP53L3MBTL1ADORA1ADORA3ADORA2A
SCHEMBL19982865 0.76 TP53 (0.36) TP53L3MBTL1ADORA1ADORA3ADORA2A
SCHEMBL28131810 0.76 LMNA (0.33) TP53L3MBTL1
SCHEMBL2020534 0.73
SCHEMBL3406050 0.73
SCHEMBL3405385 0.71 ALK (0.42) TP53L3MBTL1ADORA1ADORA3ADORA2A
SCHEMBL15758529 0.71 ALDH1A1 (0.39) TP53L3MBTL1ADORA1ADORA3ADORA2A
SCHEMBL15758528 0.71 ALDH1A1 (0.39) TP53L3MBTL1ADORA1ADORA3ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2252664-A1 ENCAPSULATED NANOSCALE PARTICLES OF ORGANIC PIGMENTS Xerox Corporation (US) 2010-11-24 EP disclosed
WO-2009126388-A1 ENCAPSULATED NANOSCALE PARTICLES OF ORGANIC PIGMENTS XEROX CORPORATION (US) 2009-10-15 WO disclosed
EP-0828762-A1 WATER-SOLUBLE COPOLYMERS CONTAINING POLYMERIZED-IN CROSS-LINKING AGENTS, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1998-03-18 EP disclosed
EP-0828763-A1 POLYMER AND SURFACTANT MIXTURES, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1998-03-18 EP disclosed
EP-0811025-A1 AGGLOMERATED FINE-PARTICLE CROSS-LINKED VINYL IMIDAZOLE COPOLYMERS, PROCESSES FOR PRODUCING THE SAID COPOLYMERS AND THE USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 1997-12-10 EP disclosed
EP-0765379-A1 COLOR MIGRATION INHIBITORS FOR WASHING AND CLEANING AGENTS BASF AKTIENGESELLSCHAFT (DE) 1997-04-02 EP disclosed
WO-1996037525-A1 WATER-SOLUBLE COPOLYMERS CONTAINING POLYMERIZED-IN CROSS-LINKING AGENTS, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1996-11-28 WO disclosed
WO-1996037598-A1 DYE TRANSFER INHIBITORS FOR DETERGENTS CONTAINING BLEACHING AGENTS BASF AKTIENGESELLSCHAFT (DE) 1996-11-28 WO disclosed
WO-1996037524-A1 POLYMER AND SURFACTANT MIXTURES, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1996-11-28 WO disclosed
EP-0731813-A1 POLYMERS OF ALKYL-1-VINYLIMIDAZOLES BASF AG (DE) 1996-09-18 EP disclosed
WO-1996026229-A1 AGGLOMERATED FINE-PARTICLE CROSS-LINKED VINYL IMIDAZOLE COPOLYMERS, PROCESSES FOR PRODUCING THE SAID COPOLYMERS AND THE USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 1996-08-29 WO disclosed
WO-1995035360-A1 COLOR MIGRATION INHIBITORS FOR WASHING AND CLEANING AGENTS BASF AKTIENGESELLSCHAFT (DE) 1995-12-28 WO disclosed
WO-1995015345-A1 POLYMERS OF ALKYL-1-VINYLIMIDAZOLES BASF AKTIENGESELLSCHAFT (DE) 1995-06-08 WO disclosed