SCHEMBL5836604

SCHEMBL5836604

CC(C)c1cnc(NC(=O)C2(c3ccccc3)CC2)s1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.71
PKM P14618 1/20 0.71
CDK2 P24941 7/20 0.61
CCNE1 P24864 6/20 0.61
CDK5 Q00535 6/20 0.61
ALDH1A1 P00352 4/20 0.60
CCNT1 O60563 1/20 0.60
CDK1 P06493 1/20 0.60
CDK4 P11802 1/20 0.60
CCNB1 P14635 1/20 0.60
CCNA2 P20248 1/20 0.60
CCND1 P24385 1/20 0.60
CDK7 P50613 1/20 0.60
CDK9 P50750 1/20 0.60
CCNH P51946 1/20 0.60
MNAT1 P51948 1/20 0.60
CDK5R1 Q15078 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
GLS O94925 2/20 0.52
USP2 O75604 1/20 0.50

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
SCHEMBL5835779 0.95 LMNA (0.65) LMNAPKMCDK2CCNE1CDK5
SCHEMBL14114594 0.89 LMNA (0.67) LMNAPKMCDK2CCNE1CDK5
SCHEMBL14114595 0.86 LMNA (0.66) LMNAPKMCDK2CCNE1CDK5
SCHEMBL14114597 0.86 LMNA (0.63) LMNAPKMCDK2CCNE1CDK5
SCHEMBL5835813 0.83 FFAR2 (0.70) LMNAPKMCDK2CCNE1CDK5
SCHEMBL14114598 0.83 LMNA (0.62) LMNAPKMCDK2CCNE1CDK5
SCHEMBL12682626 0.83 PKM (1.00) LMNAPKMALDH1A1SMN1; SMN2GLS
SCHEMBL18400427 0.82 LMNA (0.60) LMNAPKMCDK2CCNE1CDK5
SCHEMBL14131966 0.82 LMNA (0.63) LMNAPKMCDK2CCNE1CDK5
SCHEMBL2016641 0.79 LMNA (0.69) LMNAPKMALDH1A1GLSUSP2

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 8 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
CN-1325389-A 2-aminothiazole derivatives, process for preparing the same and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2001-12-05 CN 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
CN-1325389-A 2-aminothiazole derivatives, process for preparing the same and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2001-12-05 CN disclosed