SCHEMBL25028080

SCHEMBL25028080

Cn1c2ccc3ccc4c5c3c2c2c3c(ccc21)ccc(c35)n4C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.58
PIK3CA P42336 1/20 0.58
PIK3CB P42338 1/20 0.58
PIK3CG P48736 1/20 0.58
GPR3 P46089 1/20 0.38
MAPT P10636 6/20 0.35
RXFP1 Q9HBX9 1/20 0.35
ALDH1A1 P00352 6/20 0.34
CA12 O43570 2/20 0.34
CA9 Q16790 2/20 0.34
BRPF1 P55201 2/20 0.34
BRD4 O60885 1/20 0.34
KAT2B Q92831 1/20 0.34
BRD9 Q9H8M2 1/20 0.34
HPGD P15428 5/20 0.33
KDM4E B2RXH2 4/20 0.33
HSD17B10 Q99714 3/20 0.33
HTT P42858 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33

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
SCHEMBL15835097 0.78 ALDH1A1 (0.50) PIK3CDPIK3CAPIK3CBPIK3CGGPR3
SCHEMBL23007799 0.75 ALDH1A1 (0.50) PIK3CDPIK3CAPIK3CBPIK3CGGPR3
SCHEMBL30496115 0.74 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CGALDH1A1
SCHEMBL30772964 0.72 GPR3 (0.52) PIK3CDPIK3CAPIK3CBPIK3CGGPR3
SCHEMBL10023491 0.72 GPR3 (0.52) PIK3CDPIK3CAPIK3CBPIK3CGGPR3
SCHEMBL16369517 0.70 PIK3CD (0.41) PIK3CDPIK3CAPIK3CBPIK3CGGPR3
SCHEMBL17051460 0.70 GPR3 (0.54) PIK3CDPIK3CAPIK3CBPIK3CGGPR3
SCHEMBL31184703 0.69 ALDH1A1 (0.58) PIK3CDPIK3CAPIK3CBPIK3CGMAPT
SCHEMBL28417350 0.69 ALDH1A1 (0.58) PIK3CDPIK3CAPIK3CBPIK3CGMAPT
SCHEMBL3082401 0.69 ALDH1A1 (0.58) PIK3CDPIK3CAPIK3CBPIK3CGMAPT

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