SCHEMBL28522152

SCHEMBL28522152

c1ccc(N(c2ccc3ccccc3c2)c2ccc3sc4ccccc4c3c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.42
PTPN7 P35236 1/20 0.39
DUSP3 P51452 1/20 0.39
PTPN12 Q05209 1/20 0.39
PTPN22 Q9Y2R2 1/20 0.39
CYP1A2 P05177 2/20 0.38
MAPT P10636 5/20 0.37
ALDH1A1 P00352 4/20 0.37
RAB9A P51151 2/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PTGIR P43119 1/20 0.35
KDM4E B2RXH2 4/20 0.34
L3MBTL1 Q9Y468 4/20 0.34
TDP1 Q9NUW8 3/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPC1 O15118 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
SCHEMBL21968669 0.96 MAPT (0.41) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL19429057 0.96 MAPT (0.41) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL19429064 0.96 MAPT (0.41) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL20201279 0.96 MAPT (0.41) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL17740530 0.95 GPR3 (0.47) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL17740706 0.95 ALDH1A1 (0.37) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL27273323 0.93 ESR1 (0.37) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL17126478 0.93 GPR3 (0.39) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL23515783 0.93 MAPT (0.36) GPR3PTPN7DUSP3PTPN12PTPN22
SCHEMBL18927735 0.93 MAPT (0.36) GPR3PTPN7DUSP3PTPN12PTPN22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112961167-B Organic compound, light-emitting element, light-emitting device, electronic device, display device, and lighting device 株式会社半导体能源研究所 2024-06-07 CN disclosed
CN-115677715-A Organic compound, light-emitting element, light-emitting device, electronic device, display device, and lighting device 株式会社半导体能源研究所 2023-02-03 CN disclosed
CN-109153685-B Organic compound, light-emitting element, light-emitting device, electronic device, display device, and lighting device 株式会社半导体能源研究所 2022-11-22 CN disclosed
CN-112961167-A Organic compound, light-emitting element, light-emitting device, electronic device, display device, and lighting device 株式会社半导体能源研究所 2021-06-15 CN disclosed
CN-109928980-B Organic compound, light-emitting element, light-emitting device, electronic device, display device, and lighting device 株式会社半导体能源研究所 2021-03-02 CN disclosed