SCHEMBL25459284

SCHEMBL25459284

c1ccc(-c2ccc3sc4cccc(-c5ccc6c(c5)oc5cccc(-c7cccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7)c56)c4c3c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 3/20 0.34
PRKDC P78527 1/20 0.33
LIMK1 P53667 2/20 0.32
F9 P00740 2/20 0.32
PIM1 P11309 2/20 0.31
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
ROCK1 Q13464 1/20 0.31
MAP3K8 P41279 3/20 0.31
HCRTR1 O43613 1/20 0.31
SLC9A1 P19634 1/20 0.31
PLA2G10 O15496 1/20 0.31
PLA2G2A P14555 1/20 0.31
PLA2G4A P47712 1/20 0.31
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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
SCHEMBL25459275 0.98 LIMK1 (0.34) PIM3PRKDCLIMK1F9HCRTR1
SCHEMBL25459196 0.97 PIM3 (0.33) PIM3PRKDCLIMK1F9PIM1
SCHEMBL26709298 0.96 HCRTR1 (0.33) PIM3PRKDCLIMK1PIM1CSNK2A2
SCHEMBL25459189 0.95 PIM3 (0.33) PIM3PRKDCLIMK1F9PIM1
SCHEMBL25459273 0.95 PIM3 (0.36) PIM3PRKDCLIMK1F9PIM1
SCHEMBL25458835 0.95 PIM3 (0.36) PIM3PRKDCLIMK1F9PIM1
SCHEMBL25459330 0.94 PRKDC (0.37) PIM3PRKDCLIMK1F9PIM1
SCHEMBL23228089 0.94 PRKDC (0.37) PIM3PRKDCLIMK1F9PIM1
SCHEMBL25459335 0.94 PRKDC (0.36) PRKDCLIMK1F9HCRTR1SLC9A1
SCHEMBL19802130 0.93 PLA2G2A (0.34) PIM3LIMK1PIM1CSNK2A2CSNK2B

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-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 US disclosed
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 US disclosed