SCHEMBL17320263

SCHEMBL17320263

c1ccc(-c2cccc(-c3ccc4sc5ccc(-c6cccc(-c7ccc8sc9ccc(-c%10cccc(-c%11ccccc%11)c%10)cc9c8c7)c6)cc5c4c3)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.49
PIM3 Q86V86 2/20 0.47
MEN1 O00255 1/20 0.43
ESR1 P03372 1/20 0.43
KMT2A Q03164 1/20 0.43
GPR3 P46089 1/20 0.42
ROCK1 Q13464 1/20 0.42
F9 P00740 2/20 0.42
PIK3CA P42336 1/20 0.42
PI4KA P42356 1/20 0.42
PI4KB Q9UBF8 1/20 0.42
MAOA P21397 1/20 0.41
KMO O15229 1/20 0.41
ALOX5 P09917 1/20 0.40
ACMSD Q8TDX5 1/20 0.40
MAP3K8 P41279 1/20 0.40
ALDH1A1 P00352 1/20 0.39
JAK2 O60674 1/20 0.39
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39

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
SCHEMBL17057278 1.00 LIMK1 (0.49) LIMK1PIM3MEN1ESR1KMT2A
SCHEMBL14739297 1.00 LIMK1 (0.49) LIMK1PIM3MEN1ESR1KMT2A
SCHEMBL13979503 1.00 LIMK1 (0.49) LIMK1PIM3MEN1ESR1KMT2A
SCHEMBL13979506 0.98 LIMK1 (0.47) LIMK1PIM3MEN1ESR1KMT2A
SCHEMBL14410436 0.98 LIMK1 (0.47) LIMK1PIM3MEN1ESR1KMT2A
SCHEMBL16582666 0.96 LIMK1 (0.49) LIMK1PIM3MEN1ESR1KMT2A
SCHEMBL12286162 0.96 LIMK1 (0.49) LIMK1PIM3MEN1ESR1KMT2A
SCHEMBL14410442 0.96 LIMK1 (0.49) LIMK1PIM3MEN1ESR1KMT2A
SCHEMBL13979477 0.96 LIMK1 (0.49) LIMK1PIM3MEN1ESR1KMT2A
SCHEMBL29828944 0.96 LIMK1 (0.51) LIMK1PIM3MEN1ESR1KMT2A

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-20150357581-A1 TRANSPARENT ELECTRODE, ELECTRONIC DEVICE, AND ORGANIC ELECTROLUMINESCENT ELEMENT KONICA MINOLTA INC. (JP) 2015-12-10 US disclosed
US-20150357581-A1 TRANSPARENT ELECTRODE, ELECTRONIC DEVICE, AND ORGANIC ELECTROLUMINESCENT ELEMENT KONICA MINOLTA INC. (JP) 2015-12-10 US disclosed