SCHEMBL29015679

SCHEMBL29015679

c1ccc(-c2ccc3sc4c(C5(c6ccccc6)c6ccccc6-c6ccccc65)cc(-c5ccccc5)c(-c5ccccc5)c4c3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.39
CHEK1 O14757 1/20 0.38
WEE1 P30291 1/20 0.38
PIM3 Q86V86 2/20 0.33
PDK2 Q15119 1/20 0.32
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31

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
SCHEMBL21292988 0.85 CHEK1 (0.38) LIMK1CHEK1WEE1PIM3PDK2
SCHEMBL328569 0.82 LIMK1 (0.40) LIMK1PIM3PDK2PIM1PIM2
SCHEMBL21904615 0.81 MEN1 (0.35) LIMK1CHEK1WEE1
SCHEMBL24287401 0.79 PTPN1 (0.32) LIMK1
SCHEMBL29360070 0.78 LIMK1 (0.38) LIMK1PIM3PDK2PIM1PIM2
SCHEMBL283913 0.78 LIMK1 (0.38) LIMK1PIM3PDK2PIM1PIM2
SCHEMBL438625 0.76 LIMK1 (0.39) LIMK1PIM3PDK2PIM1PIM2
SCHEMBL437635 0.76 LIMK1 (0.37) LIMK1PIM3PDK2PIM1PIM2
SCHEMBL1636065 0.75 LIMK1 (0.51) LIMK1CHEK1WEE1PIM3PIM1
SCHEMBL440699 0.74 LIMK1 (0.37) LIMK1PIM3PDK2PIM1PIM2

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
CN-111051313-B Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device 株式会社半导体能源研究所 2023-06-20 CN disclosed