SCHEMBL24728628

SCHEMBL24728628

In1c2ccc(-c3ccccc3)cc2c2ccc3c4cc(-c5ccccc5)ccc4sc3c21

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 2/20 0.41
▸ PIM3 Q86V86 3/20 0.35
▸ PIM1 P11309 3/20 0.34
▸ PIM2 Q9P1W9 3/20 0.34
▸ F9 P00740 2/20 0.33
▸ ROCK1 Q13464 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ SRC P12931 1/20 0.31
▸ PRKACA P17612 1/20 0.31
▸ PRKACG P22612 1/20 0.31
▸ PRKACB P22694 1/20 0.31
▸ TSPO P30536 1/20 0.31
▸ NR4A2 P43354 2/20 0.30
▸ TNKS O95271 1/20 0.30
▸ TNKS2 Q9H2K2 1/20 0.30
▸ ALOX5 P09917 1/20 0.30
▸ PIK3CA P42336 1/20 0.30
▸ PI4KA P42356 1/20 0.30
▸ PI4KB Q9UBF8 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
SCHEMBL17196509 0.93 LIMK1 (0.38) LIMK1PIM3PIM1PIM2F9
SCHEMBL25678961 0.84 LIMK1 (0.36) LIMK1PIM3PIM1PIM2F9
SCHEMBL25678964 0.84 MAOB (0.42) LIMK1PIM3PIM1PIM2F9
SCHEMBL15138863 0.83 LIMK1 (0.40) LIMK1PIM3PIM1PIM2F9
SCHEMBL15138870 0.83 LIMK1 (0.40) LIMK1PIM3PIM1PIM2F9
SCHEMBL24728494 0.82 LIMK1 (0.34) LIMK1PIM3F9ROCK1MAOB
SCHEMBL24728626 0.79 LIMK1 (0.38) LIMK1PIM3PIM1PIM2F9
SCHEMBL25678989 0.79 LIMK1 (0.38) LIMK1PIM3PIM1PIM2F9
SCHEMBL22035308 0.79 LIMK1 (0.54) LIMK1PIM3PIM1PIM2F9
SCHEMBL1635659 0.79 LIMK1 (0.54) LIMK1PIM3PIM1PIM2F9

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
EP-4102588-A1 HOST MATERIAL, COMPOSITION, AND ORGANIC ELECTROLUMINESCENT ELEMENT Kyulux, Inc. (JP) 2022-12-14 — — EP disclosed
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