SCHEMBL25883167

SCHEMBL25883167

c1ccc(N(c2ccc3sc4ccccc4c3c2)c2ccc3ccc4sc5ccccc5c4c3c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.40
▸ CYP1A2 P05177 3/20 0.36
▸ MAPT P10636 7/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ DUSP3 P51452 2/20 0.35
▸ PTPN7 P35236 1/20 0.35
▸ PTPN12 Q05209 1/20 0.35
▸ PTPN22 Q9Y2R2 1/20 0.35
▸ TDP1 Q9NUW8 3/20 0.34
▸ POLB P06746 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ PTPN5 P54829 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PTPN11 Q06124 1/20 0.34
▸ MCL1 Q07820 1/20 0.34
▸ CTDSP1 Q9GZU7 1/20 0.34

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
SCHEMBL25879227 0.97 GPR3 (0.38) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL25883053 0.96 GPR3 (0.44) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL25883064 0.94 MAPT (0.40) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL25883173 0.94 GPR3 (0.35) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL25882202 0.93 GPR3 (0.37) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL25886418 0.92 MAPT (0.38) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL24657865 0.92 NQO1 (0.36) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL25878766 0.92 GPR3 (0.34) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL25879226 0.92 GPR3 (0.34) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL25879233 0.92 GPR3 (0.34) GPR3CYP1A2MAPTALDH1A1HPGD

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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