SCHEMBL25458236

SCHEMBL25458236

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccc(-c6ccc7c(c6)sc6ccccc67)cc5)cc5oc6ccccc6c45)n3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.33
MAPT P10636 3/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PIM3 Q86V86 1/20 0.32
PLA2G2A P14555 2/20 0.32
PLA2G4A P47712 2/20 0.32
PIK3CA P42336 1/20 0.32
PI4KA P42356 1/20 0.32
PI4KB Q9UBF8 1/20 0.32
HCRTR1 O43613 1/20 0.32
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL23822352 1.00 LIMK1 (0.33) LIMK1MAPTALDH1A1HPGDRAB9A
SCHEMBL23820414 0.99 MAPT (0.33) LIMK1MAPTALDH1A1HPGDRAB9A
SCHEMBL27277861 0.99 MAPT (0.33) LIMK1MAPTALDH1A1HPGDRAB9A
SCHEMBL22763846 0.99 MAPT (0.33) LIMK1MAPTALDH1A1HPGDRAB9A
SCHEMBL25458239 0.98 PLA2G2A (0.34) LIMK1MAPTALDH1A1HPGDRAB9A
SCHEMBL25458174 0.98 LIMK1 (0.34) LIMK1MAPTALDH1A1HPGDRAB9A
SCHEMBL23822660 0.97 PIM3 (0.35) LIMK1MAPTALDH1A1HPGDRAB9A
SCHEMBL25458181 0.96 PIM3 (0.35) LIMK1MAPTPIM3PLA2G2APLA2G4A
SCHEMBL25458175 0.96 PIM3 (0.35) LIMK1MAPTPIM3PLA2G2APLA2G4A
SCHEMBL23517475 0.96 MAPT (0.32) MAPTALDH1A1HPGDRAB9ASMN1; SMN2

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