SCHEMBL28593175

SCHEMBL28593175

Oc1ccc(-c2cccc(-c3ccccn3)n2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.70
ALDH1A1 P00352 2/20 0.70
HPGD P15428 2/20 0.70
HSD17B10 Q99714 2/20 0.70
MAPT P10636 2/20 0.70
RAB9A P51151 5/20 0.70
NPC1 O15118 4/20 0.70
KDM4E B2RXH2 4/20 0.67
CCR1 P32246 3/20 0.67
CCR5 P51681 3/20 0.67
CCR8 P51685 3/20 0.67
LMNA P02545 3/20 0.67
TP53 P04637 2/20 0.67
ALOX15 P16050 2/20 0.67
HTT P42858 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
L3MBTL1 Q9Y468 2/20 0.67
ALPL P05186 1/20 0.67
HSP90AA1 P07900 1/20 0.67

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
SCHEMBL13202960 0.90 KDM4E (0.82) POLBALDH1A1HPGDHSD17B10MAPT
SCHEMBL1669339 0.86 NPC1 (0.65) POLBALDH1A1HPGDHSD17B10MAPT
SCHEMBL29582340 0.86 NPC1 (0.65) POLBALDH1A1HPGDHSD17B10MAPT
SCHEMBL29391170 0.84 KDM4E (0.78) POLBALDH1A1HPGDHSD17B10MAPT
SCHEMBL28094546 0.84 NPC1 (0.62) POLBALDH1A1HPGDHSD17B10MAPT
SCHEMBL24712477 0.84 KDM4E (0.78) POLBALDH1A1HPGDHSD17B10MAPT
SCHEMBL2956276 0.84 NPC1 (0.62) POLBALDH1A1HPGDHSD17B10MAPT
SCHEMBL6838044 0.84 NPC1 (0.62) POLBALDH1A1HPGDHSD17B10MAPT
SCHEMBL28094694 0.84 NPC1 (0.62) POLBALDH1A1HPGDHSD17B10MAPT
Bromide SCHEMBL27909641 0.84 NPC1 (0.62) POLBALDH1A1HPGDHSD17B10MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112961102-B Metal complex and electron transport material using the same 大电株式会社 2024-03-12 CN disclosed
CN-109689665-B Metal complex and electron transport material using the same 大电株式会社 2021-10-01 CN disclosed
CN-112961102-A Metal complex and electron transport material using the same 大电株式会社 2021-06-15 CN disclosed