SCHEMBL22435706

SCHEMBL22435706

c1ccc(-c2ccccc2-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4oc5ccccc5c4c3)c(-c3ccccc3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.39
▸ HPGD P15428 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ALOX5 P09917 1/20 0.37
▸ AHR P35869 2/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ HSP90AB1 P08238 1/20 0.36
▸ PLA2G2A P14555 3/20 0.35
▸ PLA2G4A P47712 3/20 0.35
▸ TNKS O95271 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ GABRP O00591 1/20 0.33
▸ GABRD O14764 1/20 0.33
▸ CA12 O43570 1/20 0.33

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
SCHEMBL22435669 0.97 NPC1 (0.37) NPC1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL22435702 0.96 MEN1 (0.36) NPC1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL22435713 0.93 PLA2G2A (0.41) NPC1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL22435678 0.93 PLA2G2A (0.37) NPC1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL22435673 0.93 PLA2G2A (0.37) NPC1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL22435701 0.92 AHR (0.39) NPC1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL22435671 0.92 PLA2G2A (0.40) NPC1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL22435682 0.91 PLA2G2A (0.38) NPC1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL21975858 0.91 PLA2G2A (0.39) NPC1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL22435717 0.90 AHR (0.37) NPC1HPGDMAPTRAB9ASMN1; 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
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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