SCHEMBL1304833

SCHEMBL1304833

COC(=O)[C@H](CSC/C=C(\C)CC/C=C(\C)CCC=C(C)C)NC(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ICMT O60725 14/20 0.68
MAPT P10636 2/20 0.52
THRB P10828 1/20 0.52
ALDH1A1 P00352 1/20 0.49
LYPLA1 O75608 1/20 0.43

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
SCHEMBL12110882 1.00 ICMT (0.68) ICMTMAPTTHRBALDH1A1LYPLA1
SCHEMBL12466742 0.89 ICMT (0.69) ICMTMAPTALDH1A1LYPLA1
SCHEMBL12466774 0.86 ICMT (0.72) ICMTMAPTALDH1A1
SCHEMBL14596313 0.85 ICMT (0.70) ICMTMAPTALDH1A1
SCHEMBL12466619 0.84 ICMT (0.59) ICMTMAPTALDH1A1
SCHEMBL14596318 0.81 ICMT (0.63) ICMTMAPTALDH1A1
SCHEMBL5808346 0.78 MAPT (0.77) ICMTMAPTALDH1A1
SCHEMBL2880095 0.78 ICMT (0.51) ICMTMAPTALDH1A1
SCHEMBL20390363 0.78 ICMT (0.78) ICMTMAPTALDH1A1
SCHEMBL12466755 0.78 ICMT (0.61) ICMTMAPTALDH1A1

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-8592173-B2 Cancer diagnosis by measuring polyisoprenylated methylated protein methyl esterase activity FLORIDA AGRICULTURAL AND MECHANICAL UNIVERSITY (US) 2013-11-26 US claimed
US-20130084573-A1 Cancer Diagnosis by Measuring Polyisoprenylated Methylated Protein Methyl Esterase Activity NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-04-04 US claimed
WO-2012102773-A2 CANCER DIAGNOSIS BY MEASURING POLYISOPRENYLATED METHYLATED PROTEIN METHYL ESTERASE ACTIVITY FLORIDA AGRICULTURAL AND MECHANICAL UNIVERSITY (US) 2012-08-02 WO claimed
US-8053207-B1 Cancer diagnosis by measuring polyisoprenylated methylated protein methyl esterase activity Florida Agrlcultural and Mechanical University (US) 2011-11-08 US claimed
US-8592173-B2 Cancer diagnosis by measuring polyisoprenylated methylated protein methyl esterase activity FLORIDA AGRICULTURAL AND MECHANICAL UNIVERSITY (US) 2013-11-26 US disclosed
US-20130084573-A1 Cancer Diagnosis by Measuring Polyisoprenylated Methylated Protein Methyl Esterase Activity NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-04-04 US disclosed
WO-2012102773-A2 CANCER DIAGNOSIS BY MEASURING POLYISOPRENYLATED METHYLATED PROTEIN METHYL ESTERASE ACTIVITY FLORIDA AGRICULTURAL AND MECHANICAL UNIVERSITY (US) 2012-08-02 WO disclosed
US-8053207-B1 Cancer diagnosis by measuring polyisoprenylated methylated protein methyl esterase activity Florida Agrlcultural and Mechanical University (US) 2011-11-08 US disclosed