SCHEMBL29207366

SCHEMBL29207366

O=S(=O)(O)C1CCc2ccccc21.[NaH]

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.55
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
IDO1 P14902 2/20 0.42
PDPK1 O15530 1/20 0.42
ACP3 P15309 1/20 0.42
PIN1 Q13526 2/20 0.41
CYP11B2 P19099 1/20 0.40
SRD5A1 P18405 2/20 0.37
SLC18A3 Q16572 1/20 0.37

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
SCHEMBL2319101 0.98 HTR6 (0.57) HTR6CA1CA2MAOAMAOB
SCHEMBL1793811 0.87 HTR6 (0.46) HTR6CA1CA2MAOAMAOB
SCHEMBL3004778 0.86 HTR6 (0.49) HTR6IDO1
SCHEMBL3698922 0.86 HTR6 (0.45) HTR6CA1CA2MAOAMAOB
Methylamine SCHEMBL2996995 0.83 HTR6 (0.47) HTR6CA1CA2MAOAMAOB
SCHEMBL731798 0.79 HTR6 (0.61) HTR6CA1CA2MAOAMAOB
SCHEMBL16242806 0.79 HTR6 (0.57) HTR6CA1CA2MAOAMAOB
SCHEMBL2026702 0.79 HTR6 (0.57) HTR6CA1CA2MAOAMAOB
Ethylamine SCHEMBL2991122 0.79 HTT (0.44) HTR6MAOAMAOBIDO1
SCHEMBL27893026 0.79 HTR6 (0.53) HTR6CA1CA2MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114920911-B Method for producing polyisothiaindene conductive polymer 株式会社力森诺科 2024-05-03 CN disclosed