SCHEMBL25810229

SCHEMBL25810229

Cc1cc(Cl)c(Cl)c(Nc2ccccc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.49
TDP1 Q9NUW8 4/20 0.49
ALDH1A1 P00352 4/20 0.49
ALOX15 P16050 2/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.46
HPGD P15428 1/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
ATM Q13315 1/20 0.42
RAPGEF4 Q8WZA2 2/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
BRD4 O60885 1/20 0.41
BPTF Q12830 1/20 0.41
KAT2B Q92831 1/20 0.41
BRD9 Q9H8M2 1/20 0.41
CXCR2 P25025 1/20 0.40
MAPT P10636 4/20 0.39
KDM4E B2RXH2 2/20 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
SCHEMBL23908289 0.90 NPSR1 (0.50) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL29454250 0.82 GAA (0.50) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL22231911 0.82 GAA (0.50) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL9629044 0.81 ALDH1A1 (0.52) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL22051005 0.80 SLC2A1 (0.40) ALDH1A1HTTATMRAPGEF4NPC1
SCHEMBL15986613 0.79 GAA (0.65) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL10412855 0.79 HPGD (0.52) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL26778161 0.78 ALDH1A1 (0.49) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL23312041 0.77 GAA (0.42) GAATDP1ALDH1A1ALOX15HTT
SCHEMBL29573495 0.74 ALDH1A1 (0.45) GAATDP1ALDH1A1ALOX15HTT

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
US-20230200205-A1 Emitting Compound and Organic Light Emitting Device Including the Same LG DISPLAY CO., LTD. (KR) 2023-06-22 US disclosed
US-20230200205-A1 Emitting Compound and Organic Light Emitting Device Including the Same LG DISPLAY CO., LTD. (KR) 2023-06-22 US disclosed