SCHEMBL22130397

SCHEMBL22130397

Brc1cc(Br)cc(-c2cc(-c3ccc4oc5ccccc5c4c3)nc(-c3ccccc3)n2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ HPGD P15428 5/20 0.41
▸ MAPT P10636 5/20 0.41
▸ NTSR1 P30989 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ GLA P06280 1/20 0.40
▸ CYP1A1 P04798 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP1B1 Q16678 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CHEK2 O96017 1/20 0.38
▸ PLA2G2A P14555 2/20 0.37
▸ PLA2G4A P47712 2/20 0.37
▸ GABRP O00591 1/20 0.37
▸ GABRD O14764 1/20 0.37

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
SCHEMBL16185823 0.96 PLA2G2A (0.41) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22117500 0.95 PLA2G2A (0.40) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22130381 0.92 MEN1 (0.41) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22136620 0.92 MEN1 (0.37) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22136435 0.92 HCRTR1 (0.38) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22130390 0.92 HCRTR1 (0.38) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22117605 0.91 ALDH1A1 (0.41) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL15505923 0.90 MAPT (0.49) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22130419 0.90 MAPT (0.40) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22136434 0.90 MAPT (0.40) MEN1KMT2AALDH1A1HPGDMAPT

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-2020130724-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 두산솔루스 주식회사 2020-06-25 — — WO disclosed
WO-2020130724-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 두산솔루스 주식회사 2020-06-25 — — WO disclosed
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