SCHEMBL24155585

SCHEMBL24155585

c1ccc2c(c1)ccc1oc3cc(Nc4ccc5c(c4)oc4ccccc45)c4ccccc4c3c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DUSP3 P51452 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ KMT2A Q03164 7/20 0.41
▸ SMN1; SMN2 Q16637 6/20 0.41
▸ NPC1 O15118 6/20 0.41
▸ RAB9A P51151 6/20 0.41
▸ MEN1 O00255 5/20 0.41
▸ GAA P10253 4/20 0.41
▸ KDM4E B2RXH2 5/20 0.41
▸ HPGD P15428 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ MAPT P10636 3/20 0.41
▸ LMNA P02545 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ TP53 P04637 3/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL31123403 0.85 HPGD (0.49) TDP1L3MBTL1KMT2ANPC1RAB9A
SCHEMBL31123336 0.83 ABCG2 (0.45) TDP1KMT2ANPC1RAB9AMEN1
SCHEMBL21819786 0.83 ABCG2 (0.45) TDP1KMT2ANPC1RAB9AMEN1
SCHEMBL17641246 0.82 DUSP3 (0.51) DUSP3KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL14295754 0.80 DUSP3 (0.67) DUSP3KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL23168681 0.79 ALDH1A1 (0.41) DUSP3KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL24623936 0.79 DUSP3 (0.53) DUSP3KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL25734936 0.79 DUSP3 (0.53) DUSP3L3MBTL1KMT2ASMN1; SMN2NPC1
SCHEMBL24901116 0.77 DUSP3 (0.53) DUSP3KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL17742553 0.77 EPHX2 (0.55) DUSP3KMT2ASMN1; SMN2NPC1RAB9A

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-2021261851-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRIC ELEMENT 덕산네오룩스 주식회사 2021-12-30 — — WO disclosed
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