SCHEMBL4697528

SCHEMBL4697528

C[Si](C)(C)CCOCn1cnc2c1-c1ccccc1Sc1ccccc1-2

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
DGAT1 O75907 1/20 0.33
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30
EGFR P00533 1/20 0.30
IGF1R P08069 1/20 0.30
SRC P12931 1/20 0.30
FLT4 P35916 1/20 0.30
KDR P35968 1/20 0.30
FLT3 P36888 1/20 0.30
EPHB4 P54760 1/20 0.30
TEK Q02763 1/20 0.30
NPY5R Q15761 1/20 0.30
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL4697521 0.90 LMNA (0.39) BRD4CREBBPLMNA
SCHEMBL4695913 0.89 LMNA (0.38) BRD4CREBBPLMNA
SCHEMBL4692890 0.81 BRD4 (0.34) BRD4CREBBPDGAT1ALOX5APFEN1
SCHEMBL4064723 0.76 PTGS2 (0.50) DGAT1LMNA
SCHEMBL4503988 0.75 NPSR1 (0.33) DGAT1NPY5RLMNASMN1; SMN2
SCHEMBL4696533 0.74 NPC1 (0.34) NPY5RLMNASMN1; SMN2
SCHEMBL4697520 0.74 MAPK1 (0.39) BRD4CREBBPLMNASMN1; SMN2
SCHEMBL4695367 0.74 MAPK1 (0.39) BRD4CREBBPLMNASMN1; SMN2
SCHEMBL4693175 0.74 NPC1 (0.33)
SCHEMBL5225574 0.71 NPC1 (0.37) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1509528-B1 1,3-DIAZA-DIBENZOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARATION THEREOF GLAXOSMITHKLINE ZAGREB (HR) 2008-09-24 EP disclosed