SCHEMBL5815365

SCHEMBL5815365

CCN(c1ccccc1)c1nccc(-c2sc(N3CCN(C(=O)OC(C)(C)C)CC3)nc2-c2cccc(C)c2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.44
SKP1 P63208 2/20 0.44
SKP2 Q13309 2/20 0.44
ACHE P22303 2/20 0.39
MAPK14 Q16539 8/20 0.38
BRAF P15056 1/20 0.38
ABCB1 P08183 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
KIT P10721 1/20 0.37
FAAH O00519 1/20 0.37
IKBKB O14920 1/20 0.37
MAPK13 O15264 1/20 0.37
PRKD3 O94806 1/20 0.37
MAP4K4 O95819 1/20 0.37
EGFR P00533 1/20 0.37
MAPK1 P28482 1/20 0.37
FLT4 P35916 1/20 0.37
KDR P35968 1/20 0.37
FRK P42685 1/20 0.37
MAPK8 P45983 1/20 0.37

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
SCHEMBL5818651 0.83 CKS1B (0.42) CKS1BSKP1SKP2ACHEMAPK14
Cyclopentane SCHEMBL5821724 0.83 CKS1B (0.42) CKS1BSKP1SKP2ACHEMAPK14
SCHEMBL5815367 0.81 MAPK14 (0.45) CKS1BSKP1SKP2ACHEMAPK14
SCHEMBL5818618 0.81 CKS1B (0.41) CKS1BSKP1SKP2ACHEMAPK14
SCHEMBL5818184 0.81 DGAT1 (0.42) CKS1BSKP1SKP2ACHEMAPK14
SCHEMBL5817960 0.79 MAPK14 (0.44) CKS1BSKP1SKP2MAPK14BRAF
SCHEMBL5819125 0.79 CKS1B (0.38) CKS1BSKP1SKP2BRAF
SCHEMBL5818666 0.79 MAPK14 (0.43) CKS1BSKP1SKP2MAPK14BRAF
SCHEMBL5821721 0.79 GPR119 (0.40) CKS1BSKP1SKP2ACHEMAPK14
SCHEMBL5815554 0.78 SYK (0.42) CKS1BSKP1SKP2MAPK14

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
WO-2006137658-A1 NEW SUBSTITUTED 1,3-THIAZOLE DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF HAVING IMMUNOSUPPRESSION AND INFLAMMATION INHIBITORY ACITIVITY, INTERMEDIATE COMPOUNDS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, A PROCESS FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DONGBU HITEK CO., LTD. (KR) 2006-12-28 WO claimed
WO-2006137658-A1 NEW SUBSTITUTED 1,3-THIAZOLE DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF HAVING IMMUNOSUPPRESSION AND INFLAMMATION INHIBITORY ACITIVITY, INTERMEDIATE COMPOUNDS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, A PROCESS FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DONGBU HITEK CO., LTD. (KR) 2006-12-28 WO disclosed