SCHEMBL15056141

SCHEMBL15056141

CCCCOC(=O)N1CCCC1CNc1nc(Cl)ncc1Cl

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ STK17B O94768 1/20 0.39
▸ STK17A Q9UEE5 1/20 0.39
▸ GRM5 P41594 3/20 0.36
▸ BTK Q06187 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ LRRK2 Q5S007 2/20 0.35
▸ JAK3 P52333 2/20 0.34
▸ DRD2 P14416 2/20 0.33
▸ PRMT5 O14744 1/20 0.33
▸ SYK P43405 1/20 0.33
▸ DRD1 P21728 1/20 0.33
▸ DRD4 P21917 1/20 0.33
▸ DRD5 P21918 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 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
SCHEMBL15056902 0.84 STK17B (0.51) STK17BSTK17ADRD2PRMT5DRD3
SCHEMBL16337923 0.84 STK17B (0.51) STK17BSTK17ADRD2PRMT5DRD3
SCHEMBL16336962 0.84 STK17B (0.51) STK17BSTK17ADRD2PRMT5DRD3
SCHEMBL18440370 0.81 TNK2 (0.39) STK17BSTK17AGRM5BTKLRRK2
SCHEMBL16336972 0.81 STK17B (0.50) STK17BSTK17ADRD2PRMT5DRD3
SCHEMBL16336181 0.81 STK17B (0.50) STK17BSTK17ADRD2PRMT5DRD3
SCHEMBL15055509 0.81 STK17B (0.50) STK17BSTK17ADRD2PRMT5DRD3
SCHEMBL28814728 0.78 TNK2 (0.38) STK17BSTK17AGRM5BTK
SCHEMBL27987039 0.78 TNK2 (0.38) STK17BSTK17AGRM5BTK
SCHEMBL27987045 0.78 TNK2 (0.38) STK17BSTK17AGRM5BTK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2794598-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS Cellzome Limited (GB) 2014-10-29 — — EP disclosed
WO-2013092854-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2013-06-27 — — WO disclosed
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