SCHEMBL4434815

SCHEMBL4434815

Cc1ncc(Cc2ccccc2)nc1C

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.41
POLB P06746 1/20 0.41
TLR8 Q9NR97 1/20 0.40
TLR7 Q9NYK1 1/20 0.40
BRD4 O60885 1/20 0.39
ALDH1A1 P00352 2/20 0.39
TAAR1 Q96RJ0 1/20 0.39
SCD O00767 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.39
HTR2B P41595 1/20 0.38
SCN9A Q15858 1/20 0.38
CAPN1 P07384 1/20 0.37

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
SCHEMBL27072915 0.77 CALM1 (0.55) CALM1ALDH1A1TAAR1L3MBTL1LMNA
SCHEMBL13562464 0.74 HTR2B (0.46) CALM1ALDH1A1TAAR1L3MBTL1LMNA
SCHEMBL9503252 0.74 ALDH1A1 (0.44) CALM1POLBBRD4ALDH1A1L3MBTL1
SCHEMBL3992249 0.74 PDE10A (0.64) CALM1ALDH1A1LMNA
SCHEMBL13562461 0.73 SCD (0.44) CALM1POLBTLR8TLR7BRD4
SCHEMBL7197160 0.73 TLR8 (0.43) CALM1POLBTLR8TLR7BRD4
SCHEMBL7451960 0.73 PDE10A (0.36) SCN9A
SCHEMBL18763010 0.72 TP53 (0.46) CALM1TLR8TLR7BRD4ALDH1A1
SCHEMBL10385698 0.72 CKS1B (0.47) CALM1BRD4ALDH1A1L3MBTL1HTR2B
SCHEMBL27960152 0.72 LTB4R (0.40) CALM1ALDH1A1TAAR1L3MBTL1LMNA

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
EP-0779908-B1 RADIATION CURABLE RESINS COMPRISING HYPERBRANCHED POLYESTERS NESTE CHEMICALS OY (FI) 1999-12-08 EP claimed
US-5834118-A Radiation curable resins comprising hyperbranched polyesters NESTE OY OF KEILANIEMI (FI) 1998-11-10 US claimed
EP-0779908-A1 RADIATION CURABLE RESINS COMPRISING HYPERBRANCHED POLYESTERS NESTE OY (FI) 1997-06-25 EP claimed
WO-1996007688-A1 RADIATION CURABLE RESINS COMPRISING HYPERBRANCHED POLYESTERS NESTE OY (FI) 1996-03-14 WO claimed
JP-5279450-A None JP disclosed
US-20090266585-A1 Flame-Retardant Composition for Solder Resist and Cured Product Thereof SHOWDA DENKO K.K. (JP) 2009-10-29 US disclosed
EP-1864187-A1 FLAME-RETARDANT COMPOSITION FOR SOLDER RESIST AND CURED PRODUCT THEREOF SHOWA DENKO KABUSHIKI KAISHA (JP) 2007-12-12 EP disclosed
WO-2006106892-A1 FLAME-RETARDANT COMPOSITION FOR SOLDER RESIST AND CURED PRODUCT THEREOF SHOWA DENKO K.K. (JP) 2006-10-12 WO disclosed
JP-H05279450-A EPOXY RESIN COMPOSITION DAINIPPON INK & CHEM INC 1993-10-26 JP disclosed