SCHEMBL25880846

SCHEMBL25880846

c1ccc(-c2ccccc2-c2ccc(N(c3ccccc3)c3cccc4c3ccc3sc5ccccc5c34)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ F9 P00740 1/20 0.36
▸ GPR3 P46089 1/20 0.32
▸ LIMK1 P53667 1/20 0.32
▸ APP P05067 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ DUSP3 P51452 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ PTPN5 P54829 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PTPN11 Q06124 1/20 0.31
▸ MCL1 Q07820 1/20 0.31
▸ CTDSP1 Q9GZU7 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ SLC9A1 P19634 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
SCHEMBL25880359 0.94 GPR3 (0.34) F9GPR3APPMEN1POLB
SCHEMBL24527176 0.94 GPR3 (0.34) F9GPR3APPMEN1POLB
SCHEMBL25881003 0.91 F9 (0.35) F9GPR3LIMK1ALOX5MEN1
SCHEMBL25880725 0.91 F9 (0.35) F9GPR3LIMK1ALOX5MEN1
SCHEMBL25885183 0.91 F9 (0.36) F9GPR3APPALOX5MEN1
SCHEMBL25880849 0.91 F9 (0.41) F9GPR3LIMK1APPALOX5
SCHEMBL25881013 0.90 F9 (0.39) F9GPR3LIMK1ALOX5MEN1
SCHEMBL25884626 0.90 F9 (0.33) F9LIMK1ALOX5
SCHEMBL26556781 0.89 F9 (0.33) F9LIMK1ALOX5SLC9A1
SCHEMBL26556743 0.89 F9 (0.37) F9LIMK1MCL1SLC9A1

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
WO-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 — — WO disclosed
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