SCHEMBL5835686

SCHEMBL5835686

COc1ccc(OC)c(NC(=O)Nc2ccc(C(=O)Nc3ncc(C(C)C)s3)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.55
HTT P42858 3/20 0.55
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
MEN1 O00255 8/20 0.53
KMT2A Q03164 8/20 0.53
GAA P10253 3/20 0.53
TP53 P04637 3/20 0.53
CCNE1 P24864 2/20 0.53
CDK2 P24941 2/20 0.53
CDK5 Q00535 2/20 0.53
POLB P06746 1/20 0.53
MAPK1 P28482 3/20 0.50
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.47
NAMPT P43490 1/20 0.47
CSNK2A2 P19784 2/20 0.47
CSNK2A1 P68400 2/20 0.47
RECQL P46063 1/20 0.46
NTRK1 P04629 1/20 0.46

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
SCHEMBL6285364 0.89 MAPT (0.56) MAPTHTTKDM4EALDH1A1MEN1
SCHEMBL5835744 0.87 CDK2 (0.61) MAPTHTTALDH1A1MEN1KMT2A
SCHEMBL5835991 0.82 CCNE1 (0.71) HTTKDM4EMEN1KMT2ATP53
SCHEMBL6283718 0.81 CDK2 (0.72) MAPTHTTKDM4EALDH1A1MEN1
SCHEMBL6279278 0.80 CDK2 (0.58) MAPTHTTKDM4EALDH1A1MEN1
SCHEMBL5835381 0.79 CDK2 (0.63) MAPTHTTKDM4EALDH1A1MEN1
SCHEMBL6282768 0.78 CDK2 (0.64) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL6287790 0.78 KMT2A (0.56) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL5835450 0.78 NPC1 (0.58) KDM4EALDH1A1MEN1KMT2AGAA
SCHEMBL5836697 0.77 CCNE1 (0.59) MAPTHTTMEN1KMT2ACCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7037929-B1 2-amino-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN S.P.A. (IT) 2006-05-02 US claimed
EP-1124810-B9 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-12-28 EP claimed
EP-1124810-B1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-05-04 EP claimed
US-7037929-B1 2-amino-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN S.P.A. (IT) 2006-05-02 US disclosed
EP-1124810-B9 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-12-28 EP disclosed
EP-1124810-B1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-05-04 EP disclosed