SCHEMBL13327258

SCHEMBL13327258

c1ccc2c(c1)-c1ccccc1C2OC1c2ccccc2-c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.44
HTR2A P28223 1/20 0.44
POLB P06746 2/20 0.41
ACHE P22303 3/20 0.39
BCHE P06276 2/20 0.39
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
NCOR2 Q9Y618 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
CHRM2 P08172 1/20 0.35

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
SCHEMBL28831999 0.81 CA1 (0.40) GPR3HTR2APOLBACHEBCHE
SCHEMBL5473773 0.78 HTR2A (0.46) GPR3HTR2APOLBACHEBCHE
SCHEMBL10518378 0.78 GPR3 (0.46) GPR3HTR2APOLBACHEBCHE
SCHEMBL29090326 0.78 GPR3 (0.41) GPR3HTR2APOLBACHEBCHE
SCHEMBL2138659 0.78 POLB (0.43) GPR3HTR2APOLBACHEBCHE
SCHEMBL21951947 0.74 HTR2A (0.48) GPR3HTR2APOLBACHEBCHE
SCHEMBL14119904 0.74 SLC6A2 (0.42) GPR3HTR2APOLBACHEBCHE
SCHEMBL24133133 0.72 POLB (0.39) GPR3HTR2APOLBACHEBCHE
SCHEMBL156273 0.72 POLB (0.39) GPR3HTR2APOLBACHEBCHE
SCHEMBL10447563 0.72 ACHE (0.46) GPR3HTR2APOLBACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118336148-A Sulfur anode-based water system battery 复旦大学 2024-07-12 CN claimed
CN-115000480-A High-energy-density alkaline iron-sulfur flow battery and preparation method thereof 长沙理工大学 2022-09-02 CN claimed
CN-110305313-A A kind of purpurine functional poly aryl oxide electrode active material and preparation method thereof 福州大学 2019-10-08 CN claimed
CN-118336148-A Sulfur anode-based water system battery 复旦大学 2024-07-12 CN disclosed
CN-116315153-A Dual-purpose electrolyte for water-based zinc-sulfur battery 北京理工大学 2023-06-23 CN disclosed
CN-110305313-A A kind of purpurine functional poly aryl oxide electrode active material and preparation method thereof 福州大学 2019-10-08 CN disclosed
US-7723915-B2 Organic light-emitting device and display apparatus CANON KABUSHIKI KAISHA (JP) 2010-05-25 US disclosed
US-7723915-B2 Organic light-emitting device and display apparatus CANON KABUSHIKI KAISHA (JP) 2010-05-25 US disclosed
US-20090082439-A1 ORGANIC LIGHT-EMITTING DEVICE AND DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2009-03-26 US disclosed
US-20090082439-A1 ORGANIC LIGHT-EMITTING DEVICE AND DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2009-03-26 US disclosed