SCHEMBL25028265

SCHEMBL25028265

CN1c2ccccc2Sc2ccc(-c3cccnc3)cc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.54
▸ MAPT P10636 2/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ NOX1 Q9Y5S8 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ DRD2 P14416 1/20 0.52
▸ CYP11B2 P19099 9/20 0.50
▸ CYP11B1 P15538 8/20 0.50
▸ CYP17A1 P05093 3/20 0.50
▸ CYP19A1 P11511 3/20 0.50
▸ CYP1A2 P05177 2/20 0.50
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ ADRA2A P08913 1/20 0.47

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
SCHEMBL25026632 0.87 CYP11B2 (0.57) DRD2CYP11B2CYP11B1CYP17A1CYP19A1
SCHEMBL23954364 0.84 MAOA (0.59) MAOAMAPTL3MBTL1NOX1LMNA
SCHEMBL16810782 0.83 MAOA (0.68) MAOAMAPTL3MBTL1NOX1LMNA
SCHEMBL16810642 0.78 MAOA (0.57) MAOAMAPTL3MBTL1NOX1LMNA
SCHEMBL13846948 0.77 MAOA (0.58) MAOAMAPTL3MBTL1NOX1LMNA
SCHEMBL7170967 0.76 MAOA (0.73) MAOAMAPTL3MBTL1NOX1LMNA
SCHEMBL19054957 0.75 MAOA (0.56) MAOAMAPTL3MBTL1NOX1LMNA
SCHEMBL16810786 0.75 MAOA (0.66) MAOAMAPTL3MBTL1NOX1LMNA
SCHEMBL29634104 0.75 MAOA (0.66) MAOAMAPTL3MBTL1NOX1LMNA
SCHEMBL13847168 0.74 CYP11B2 (0.45) MAPK1CYP11B2CYP11B1CYP17A1CYP19A1

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
US-20230050869-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 — — US disclosed
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