SCHEMBL25118928

SCHEMBL25118928

CN1C(=O)C2(CCCCC2)N(C)c2nc(Nc3ccc(SN)cc3)ncc21

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STK4 Q13043 10/20 0.75
▸ STK3 Q13188 1/20 0.45
▸ PSEN1 P49768 1/20 0.44
▸ PSEN2 P49810 1/20 0.44
▸ APH1B Q8WW43 1/20 0.44
▸ NCSTN Q92542 1/20 0.44
▸ APH1A Q96BI3 1/20 0.44
▸ PSENEN Q9NZ42 1/20 0.44
▸ PLK1 P53350 5/20 0.42
▸ PLK3 Q9H4B4 3/20 0.42
▸ PLK2 Q9NYY3 3/20 0.42
▸ MAPK7 Q13164 2/20 0.42
▸ DYRK1A Q13627 1/20 0.42
▸ PIK3CD O00329 1/20 0.41
▸ AURKA O14965 1/20 0.41
▸ DCLK1 O15075 1/20 0.41
▸ PIK3C2G O75747 1/20 0.41
▸ PIK3CG P48736 1/20 0.41
▸ LRRK2 Q5S007 1/20 0.41
▸ AURKB Q96GD4 1/20 0.41

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
SCHEMBL25060508 0.99 STK4 (0.75) STK4STK3PSEN1PSEN2APH1B
SCHEMBL24928824 0.87 STK4 (0.76) STK4PSEN1PSEN2APH1BNCSTN
SCHEMBL23998718 0.86 STK4 (1.00) STK4STK3PLK1PLK3PLK2
SCHEMBL25060520 0.85 STK4 (0.75) STK4STK3PSEN1PSEN2APH1B
SCHEMBL23998712 0.85 STK4 (1.00) STK4STK3PLK1PLK3PLK2
SCHEMBL23998720 0.83 STK4 (1.00) STK4STK3PLK1PLK3PLK2
SCHEMBL25060523 0.82 STK4 (0.74) STK4STK3PSEN1PSEN2APH1B
SCHEMBL23998724 0.80 STK4 (1.00) STK4STK3PLK1PLK3PLK2
SCHEMBL25060514 0.80 STK4 (0.73) STK4STK3PSEN1PSEN2APH1B
SCHEMBL25060581 0.78 STK4 (0.71) STK4STK3MAPK7PIK3CDAURKA

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
EP-4159845-A1 CULTURE MEDIUM FOR LARYNGEAL CANCER EPITHELIAL CELLS, CULTURE METHOD, AND APPLICATION THEREOF CAS (Hefei) Institute of Technology Innovation (CN) 2023-04-05 — — EP disclosed
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