SCHEMBL15470248

SCHEMBL15470248

Cc1ccc2c(c1)N(C)c1cc(-c3ccccc3)ccc1N2c1ccc(-c2ccc(-c3ccc4sc5ccccc5c4c3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 1/20 0.33
PMM2 O15305 2/20 0.33
MPI P34949 2/20 0.33
PHOSPHO1 Q8TCT1 2/20 0.33
ROCK1 Q13464 1/20 0.33
GPR3 P46089 1/20 0.32
PTPN7 P35236 1/20 0.32
DUSP3 P51452 1/20 0.32
PTPN12 Q05209 1/20 0.32
PTPN22 Q9Y2R2 1/20 0.32
LIMK1 P53667 1/20 0.32
ACLY P53396 1/20 0.31
CYP1A2 P05177 1/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
TDP1 Q9NUW8 2/20 0.30
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 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
SCHEMBL15470247 0.94 PIM3 (0.36) PIM3ROCK1GPR3PTPN7DUSP3
SCHEMBL15470350 0.86 ALOX5 (0.42) PMM2MPIPHOSPHO1MAPT
SCHEMBL15470254 0.85 PDE6D (0.36) PIM3ROCK1
SCHEMBL15470253 0.84 GPR3 (0.38) PIM3ROCK1GPR3PTPN7DUSP3
SCHEMBL15470211 0.84 PIM3 (0.33) PIM3PMM2MPIPHOSPHO1ROCK1
SCHEMBL15470245 0.84 GPR3 (0.42) PIM3ROCK1GPR3PTPN7DUSP3
SCHEMBL15470174 0.83 LIMK1 (0.33) PIM3PMM2MPIPHOSPHO1ROCK1
SCHEMBL15470249 0.83 PIM3 (0.37) PIM3ROCK1GPR3PTPN7DUSP3
SCHEMBL15470207 0.82 GPR3 (0.34) PIM3PMM2MPIPHOSPHO1ROCK1
SCHEMBL15470172 0.81 GPR3 (0.33) PIM3PMM2MPIPHOSPHO1GPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140042412-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT-EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2014-02-13 US disclosed
US-20140042412-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT-EMITTING DIODE CHEIL INDUSTRIES, INC. (KR) 2014-02-13 US disclosed