SCHEMBL21176923

SCHEMBL21176923

CCOC(=O)c1nc(SC)nnc1-c1ccccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.47
▸ HPGD P15428 2/20 0.47
▸ CDC7 O00311 1/20 0.47
▸ DBF4 Q9UBU7 1/20 0.47
▸ NPSR1 Q6W5P4 4/20 0.45
▸ LMNA P02545 2/20 0.45
▸ GRM6 O15303 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ HTT P42858 1/20 0.43
▸ PDE2A O00408 1/20 0.41
▸ PDE10A Q9Y233 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ DHODH Q02127 2/20 0.40
▸ CACNA2D1 P54289 1/20 0.39

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
SCHEMBL6866229 0.81 MAPT (0.58) MAPTHPGDNPSR1LMNAMEN1
SCHEMBL21177365 0.79 CDC7 (0.48) MAPTHPGDCDC7DBF4NPSR1
SCHEMBL31289927 0.76 MEN1 (0.44) MAPTHPGDNPSR1LMNAMEN1
SCHEMBL10815512 0.75 NPSR1 (0.51) MAPTHPGDNPSR1LMNAMEN1
SCHEMBL13528413 0.74 MEN1 (0.44) MAPTNPSR1LMNAMEN1KMT2A
SCHEMBL5925649 0.74 MEN1 (0.42) MAPTHPGDNPSR1LMNAMEN1
SCHEMBL29558416 0.74 MEN1 (0.42) MAPTHPGDNPSR1LMNAMEN1
SCHEMBL17964234 0.71 ALDH1A1 (0.53) MAPTHPGDNPSR1LMNAMEN1
SCHEMBL13780284 0.70 MAPT (0.48) MAPTHPGDNPSR1LMNAMEN1
SCHEMBL3919273 0.70 SLC9A1 (0.56) MAPTHPGDCDC7DBF4NPSR1

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
WO-2019141552-A1 HERBICIDAL TRIAZINE COMPOUNDS BASF SE (DE) 2019-07-25 — — WO disclosed
Send feedback