SCHEMBL25459273

SCHEMBL25459273

c1ccc(-c2ccc3sc4ccc(-c5ccc6c(c5)oc5cccc(-c7cccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7)c56)cc4c3c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 3/20 0.36
LIMK1 P53667 1/20 0.34
MAP3K8 P41279 3/20 0.33
PIM1 P11309 2/20 0.33
CSNK2A2 P19784 1/20 0.33
CSNK2B P67870 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
ROCK1 Q13464 1/20 0.33
HCRTR1 O43613 1/20 0.33
PRKDC P78527 1/20 0.32
PLA2G2A P14555 3/20 0.32
PLA2G4A P47712 3/20 0.32
PLA2G10 O15496 1/20 0.32
F9 P00740 2/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32

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
SCHEMBL25459264 0.97 PIM3 (0.36) PIM3LIMK1MAP3K8PIM1CSNK2A2
SCHEMBL23228089 0.97 PRKDC (0.37) PIM3LIMK1MAP3K8PIM1CSNK2A2
SCHEMBL25459272 0.97 PIM3 (0.36) PIM3LIMK1MAP3K8PIM1CSNK2A2
SCHEMBL25459330 0.97 PRKDC (0.37) PIM3LIMK1MAP3K8PIM1CSNK2A2
SCHEMBL23228110 0.96 PRKDC (0.37) PIM3LIMK1HCRTR1PRKDCPLA2G2A
SCHEMBL25458794 0.96 PIM3 (0.37) PIM3LIMK1PIM1CSNK2A2CSNK2B
SCHEMBL23228204 0.96 PIM3 (0.37) PIM3LIMK1PIM1CSNK2A2CSNK2B
SCHEMBL25459333 0.96 PRKDC (0.37) PIM3LIMK1HCRTR1PRKDCPLA2G2A
SCHEMBL25459284 0.95 PIM3 (0.34) PIM3LIMK1MAP3K8PIM1CSNK2A2
SCHEMBL25459187 0.94 PIM3 (0.36) 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