SCHEMBL25026632

SCHEMBL25026632

CN1c2ccc(-c3cccnc3)cc2Sc2cc(-c3cccnc3)ccc21

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 14/20 0.57
▸ CYP11B1 P15538 12/20 0.57
▸ CYP1A2 P05177 3/20 0.57
▸ CYP17A1 P05093 3/20 0.57
▸ CYP19A1 P11511 3/20 0.57
▸ CYP3A4 P08684 2/20 0.47
▸ CYP2A6 P11509 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ DRD2 P14416 1/20 0.46
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2B6 P20813 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ PSIP1 O75475 1/20 0.44
▸ AXL P30530 1/20 0.44
▸ MKNK1 Q9BUB5 1/20 0.44
▸ MKNK2 Q9HBH9 1/20 0.44

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
SCHEMBL25028265 0.87 MAOA (0.54) CYP11B2CYP11B1CYP1A2CYP17A1CYP19A1
SCHEMBL13847168 0.83 CYP11B2 (0.45) CYP11B2CYP11B1CYP1A2CYP17A1CYP19A1
SCHEMBL25026631 0.80 ICMT (0.47) CYP11B2CYP11B1CYP1A2CYP17A1CYP19A1
SCHEMBL2493673 0.80 MAOA (0.55) DRD2MEN1
SCHEMBL1881170 0.79 CYP11B1 (0.65) CYP11B2CYP11B1CYP1A2CYP17A1CYP19A1
SCHEMBL13846948 0.77 MAOA (0.58) CYP1A2CYP3A4DRD2MEN1
SCHEMBL7170967 0.76 MAOA (0.73) CYP1A2ALDH1A1DRD2CYP2C19MEN1
SCHEMBL13507665 0.76 CYP11B2 (0.51) CYP11B2CYP11B1CYP1A2CYP17A1CYP19A1
SCHEMBL16810786 0.76 MAOA (0.66) ALDH1A1DRD2MEN1
SCHEMBL29634104 0.76 MAOA (0.66) ALDH1A1DRD2MEN1

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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