SCHEMBL28859068

SCHEMBL28859068

OB(O)c1cc2ccsc2c2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
CYP2A6 P11509 1/20 0.34
SLC2A1 P11166 1/20 0.32
MGLL Q99685 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
ENPP2 Q13822 1/20 0.31

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
SCHEMBL11556458 0.77 CYP1A2 (0.41) CYP2A6
SCHEMBL9526464 0.73 CYP2A6 (0.53) CYP2A6
SCHEMBL11310484 0.73 MAPT (0.44) MAPTCA1CA2
SCHEMBL28859146 0.72 MAPT (0.48) MAPT
SCHEMBL12144585 0.71 MAPT (0.42) MAPTCYP2A6MGLLCA1CA2
SCHEMBL368234 0.71 TRPM4 (0.54) MAPTCYP2A6CA1CA2
SCHEMBL394147 0.71 CYP2A6 (0.50) MAPTCYP2A6ENPP2
SCHEMBL10734164 0.69 ALDH1A1 (0.33) CYP2A6
SCHEMBL11558958 0.69 SLC2A1 (0.36) CYP2A6SLC2A1
SCHEMBL2399644 0.68 MAPT (0.46) MAPTMGLLCA1CA2ENPP2

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-113169276-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2024-02-02 CN disclosed
CN-111354873-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2023-10-31 CN disclosed
CN-108026111-A Organic electric element compound, organic electric element and its electronic device using it 德山新勒克斯有限公司 2018-05-11 CN disclosed