SCHEMBL22435896

SCHEMBL22435896

c1ccc(-c2ccc(N(c3ccc(-c4cccc5sc6ccccc6c45)cc3)c3ccc(-c4cc(-c5ccccc5)ccc4-c4ccccc4)cc3-c3ccccc3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 1/20 0.34
▸ F9 P00740 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ MEN1 O00255 1/20 0.31
▸ APAF1 O14727 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ XBP1 P17861 1/20 0.31
▸ PTBP1 P26599 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ GALK1 P51570 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ SMAD3 P84022 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL22435912 1.00 LIMK1 (0.34) LIMK1F9ALOX5PTPN1MEN1
SCHEMBL22435905 0.99 F9 (0.34) LIMK1F9ALOX5PTPN1MEN1
SCHEMBL22435903 0.96 LIMK1 (0.36) LIMK1F9ALOX5PTPN1SLC9A1
SCHEMBL22435908 0.95 F9 (0.36) LIMK1F9ALOX5PTPN1MEN1
SCHEMBL22435894 0.94 F9 (0.35) LIMK1F9ALOX5PTPN1MEN1
SCHEMBL22435910 0.93 F9 (0.34) LIMK1F9ALOX5PTPN1MEN1
SCHEMBL24999296 0.92 F9 (0.36) LIMK1F9ALOX5PTPN1MEN1
SCHEMBL22435620 0.91 F9 (0.31) F9ALOX5PTPN1
SCHEMBL22435618 0.91 F9 (0.31) F9ALOX5PTPN1
SCHEMBL22435897 0.91 PTPN1 (0.35) LIMK1F9ALOX5PTPN1L3MBTL1

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
WO-2020185054-A9 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 (KR) 2020-11-26 — — WO disclosed
WO-2020185054-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-09-17 — — WO disclosed
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