SCHEMBL5836044

SCHEMBL5836044

COc1ccc(CC(=O)Nc2ncc(C(C)C)s2)cc1OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.67
ALDH1A1 P00352 3/20 0.67
MAPT P10636 1/20 0.67
CASP7 P55210 1/20 0.67
CASP6 P55212 1/20 0.67
CTDSP1 Q9GZU7 1/20 0.67
SMN1; SMN2 Q16637 5/20 0.65
CCNT1 O60563 1/20 0.65
CDK1 P06493 1/20 0.65
CDK4 P11802 1/20 0.65
CCNB1 P14635 1/20 0.65
CCNA2 P20248 1/20 0.65
CCND1 P24385 1/20 0.65
CCNE1 P24864 1/20 0.65
CDK2 P24941 1/20 0.65
CDK7 P50613 1/20 0.65
CDK9 P50750 1/20 0.65
CCNH P51946 1/20 0.65
MNAT1 P51948 1/20 0.65
CDK5 Q00535 1/20 0.65

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
SCHEMBL5835475 0.91 SMN1; SMN2 (0.63) LMNAALDH1A1MAPTCASP7CASP6
SCHEMBL5835509 0.90 SMN1; SMN2 (0.61) LMNAALDH1A1MAPTCASP7CASP6
SCHEMBL5836259 0.90 CCNE1 (0.68) LMNAALDH1A1MAPTCASP7CASP6
SCHEMBL5835667 0.87 SMN1; SMN2 (0.73) LMNAALDH1A1MAPTCASP7CASP6
SCHEMBL5835602 0.85 CDK5 (0.73) LMNAALDH1A1MAPTSMN1; SMN2CCNT1
SCHEMBL6282804 0.84 ALDH1A1 (0.57) LMNAALDH1A1MAPTCASP7CASP6
SCHEMBL5835984 0.83 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2CCNT1CDK1CDK4
SCHEMBL5836030 0.82 CDK2 (0.70) LMNAALDH1A1MAPTCASP7CASP6
SCHEMBL5835758 0.82 CCNE1 (0.66) LMNAALDH1A1MAPTCASP7CASP6
SCHEMBL5835765 0.82 GLS (0.60) LMNAALDH1A1MAPTCASP7CASP6

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