SCHEMBL27020992

SCHEMBL27020992

c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3c2sc2ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.38
PIM3 Q86V86 3/20 0.34
PIM1 P11309 3/20 0.34
PIM2 Q9P1W9 3/20 0.34
TSPO P30536 1/20 0.33
ALOX5 P09917 1/20 0.33
ROCK1 Q13464 1/20 0.32
NPY5R Q15761 1/20 0.32
ALDH1A1 P00352 2/20 0.32
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
PTGER4 P35408 1/20 0.31
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
PIK3CA P42336 1/20 0.30
PI4KA P42356 1/20 0.30
PI4KB Q9UBF8 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 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
SCHEMBL24216384 0.97 LIMK1 (0.39) LIMK1PIM3PIM1PIM2ALOX5
SCHEMBL24216407 0.97 LIMK1 (0.38) LIMK1PIM3PIM1PIM2ALOX5
SCHEMBL25928790 0.95 LIMK1 (0.37) LIMK1PIM3PIM1PIM2ALOX5
SCHEMBL24216667 0.95 LIMK1 (0.36) LIMK1PIM3PIM1PIM2ALOX5
SCHEMBL22672148 0.95 KDM4E (0.38) LIMK1PIM3PIM1PIM2ALOX5
SCHEMBL24216659 0.94 LIMK1 (0.37) LIMK1PIM3PIM1PIM2ALOX5
SCHEMBL24216123 0.92 LIMK1 (0.37) LIMK1PIM3TSPOALOX5NPY5R
SCHEMBL22078841 0.92 LIMK1 (0.34) LIMK1PIM3PIM1PIM2ALOX5
SCHEMBL22078844 0.92 LIMK1 (0.34) LIMK1PIM3PIM1PIM2ALOX5
SCHEMBL26004333 0.92 LIMK1 (0.34) LIMK1PIM3PIM1PIM2ALOX5

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-4307402-A1 ORGANIC LIGHT EMITTING DEVICE Lg Chem, Ltd. (KR) 2024-01-17 EP disclosed