SCHEMBL25459472

SCHEMBL25459472

c1ccc(-c2ccc3sc4cccc(-c5ccc6oc7cccc(-c8cccc(-c9nc(-c%10ccccc%10)nc(-c%10ccccc%10)n9)c8)c7c6c5)c4c3c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM3 Q86V86 2/20 0.36
▸ PIM1 P11309 1/20 0.36
▸ CSNK2A2 P19784 1/20 0.36
▸ CSNK2B P67870 1/20 0.36
▸ PIM2 Q9P1W9 1/20 0.36
▸ PLA2G2A P14555 4/20 0.36
▸ PLA2G4A P47712 4/20 0.36
▸ PLA2G10 O15496 1/20 0.36
▸ LIMK1 P53667 2/20 0.35
▸ PRKDC P78527 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ ROCK1 Q13464 1/20 0.32
▸ MAP3K8 P41279 3/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ SENP7 Q9BQF6 1/20 0.32
▸ SENP6 Q9GZR1 1/20 0.32
▸ TBK1 Q9UHD2 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
SCHEMBL23058887 0.98 PIM3 (0.35) PIM3PIM1CSNK2A2CSNK2BPIM2
SCHEMBL25459464 0.98 LIMK1 (0.37) PIM3PIM1CSNK2A2CSNK2BPIM2
SCHEMBL23058832 0.97 PIM3 (0.35) PIM3PIM1CSNK2A2CSNK2BPIM2
SCHEMBL23058026 0.97 PIM3 (0.35) PIM3PIM1CSNK2A2CSNK2BPIM2
SCHEMBL20871457 0.96 PLA2G2A (0.36) PIM3PIM1CSNK2A2CSNK2BPIM2
SCHEMBL25459368 0.95 PIM3 (0.35) PIM3PIM1CSNK2A2CSNK2BPIM2
SCHEMBL25459538 0.94 PLA2G2A (0.39) PIM3PIM1CSNK2A2CSNK2BPIM2
SCHEMBL23138925 0.94 LIMK1 (0.36) PIM3PIM1CSNK2A2CSNK2BPIM2
SCHEMBL25459463 0.94 PLA2G2A (0.38) PIM3PIM1CSNK2A2CSNK2BPIM2
SCHEMBL19802826 0.94 PLA2G2A (0.37) PIM3PIM1CSNK2A2CSNK2BPIM2

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
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