SCHEMBL25028171

SCHEMBL25028171

CN1c2ccc(-c3cccs3)cc2Sc2cc(-c3cccs3)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.46
▸ NOX1 Q9Y5S8 6/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ ADRA2A P08913 1/20 0.45
▸ ADRA2B P18089 1/20 0.45
▸ ADRA2C P18825 1/20 0.45
▸ CHRM3 P20309 1/20 0.45
▸ SLC6A2 P23975 1/20 0.45
▸ HTR2C P28335 1/20 0.45
▸ SLC6A4 P31645 1/20 0.45
▸ DRD3 P35462 1/20 0.45
▸ HTR2B P41595 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ MAOA P21397 1/20 0.44
▸ SRD5A1 P18405 1/20 0.40
▸ SNCA P37840 2/20 0.40
▸ ERN1 O75460 1/20 0.40
▸ PRMT6 Q96LA8 1/20 0.40
▸ LTA4H P09960 1/20 0.40

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
SCHEMBL23954268 0.79 KDM4E (0.42) KCNH2ADRA2AADRA2BADRA2CCHRM3
SCHEMBL16166554 0.78 KCNH2 (0.55) KCNH2ERN1PRMT6LTA4HHDAC1
SCHEMBL2493673 0.75 MAOA (0.55) NOX1L3MBTL1MEN1ADRA2AADRA2B
SCHEMBL7170967 0.75 MAOA (0.73) KCNH2NOX1L3MBTL1MEN1ADRA2A
SCHEMBL31314359 0.72 KDM4E (0.40) KCNH2MEN1HTR2BKMT2ASRD5A1
SCHEMBL15571195 0.72 HDAC1 (0.62) SRD5A1HDAC1HDAC2HDAC3LMNA
SCHEMBL16810786 0.71 MAOA (0.66) NOX1L3MBTL1MEN1ADRA2AADRA2B
SCHEMBL29634104 0.71 MAOA (0.66) NOX1L3MBTL1MEN1ADRA2AADRA2B
SCHEMBL2501568 0.71 NOX1 (0.50) NOX1L3MBTL1MEN1ADRA2AADRA2B
SCHEMBL19649400 0.70 NOX1 (0.49) NOX1L3MBTL1MEN1ADRA2AADRA2B

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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