SCHEMBL3439628

SCHEMBL3439628

COc1cc(C(=O)NC(=O)[C@@H](N)Cc2ccccc2)cc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.44
ALDH1A1 P00352 3/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
OPRK1 P41145 1/20 0.44
ROCK2 O75116 1/20 0.43
ROCK1 Q13464 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
AAK1 Q2M2I8 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HPGD P15428 1/20 0.42
SCN5A Q14524 1/20 0.42
SCN2A Q99250 1/20 0.42
SLC7A5 Q01650 2/20 0.41
CYP3A4 P08684 1/20 0.41
GAA P10253 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL9115641 0.86 MMP2 (0.41) ALDH1A1LMNAKDM4ECYP3A4
SCHEMBL4609875 0.85 LARS1 (0.43) AAK1CYP3A4
SCHEMBL16061398 0.82 REN (0.44) OPRK1TSHR
SCHEMBL23175206 0.80 BACE1 (0.46) OPRK1
SCHEMBL1404234 0.79 LTA4H (0.42) ALDH1A1LMNAKDM4ESMN1; SMN2HTT
SCHEMBL6828289 0.78 NAMPT (0.57) NAMPTTDP1SLC7A5RAB9A
SCHEMBL9643959 0.78 OPRK1 (0.45) NAMPTALDH1A1KDM4EOPRK1ROCK2
SCHEMBL5743374 0.76 NAMPT (0.62) NAMPTALDH1A1SLC7A5
SCHEMBL7700701 0.76 NAMPT (0.62) NAMPTALDH1A1SLC7A5
SCHEMBL3625128 0.72 SLC7A5 (0.56) OPRK1SLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8632989-B1 Mutant insulin degrading enzyme and methods of use UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2014-01-21 US disclosed
US-7807396-B2 Insulin degrading enzyme assays for treatment of alzheimer's disease UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2010-10-05 US disclosed
CN-101321863-A Fusion proteins with modulated plasma half-life ASTRAZENECA AB (SE) 2008-12-10 CN disclosed
US-20080274096-A1 Fusion Proteins Having a Modulated Half-Life in Plasma ASTRAZENECA AB (SE) 2008-11-06 US disclosed
EP-1934341-A1 FUSION PROTEINS HAVING A MODULATED HALF-LIFE IN PLASMA AstraZeneca AB (SE) 2008-06-25 EP disclosed
WO-2007040437-A1 FUSION PROTEINS HAVING A MODULATED HALF-LIFE IN PLASMA ASTRAZENECA AB (SE) 2007-04-12 WO disclosed
US-20060087736-A1 Amyloid peptide inactivating enzyme to treat alzheimer's disease UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2006-04-27 US disclosed
WO-2003102016-A2 AMYLOID PEPTIDE INACTIVATING ENZYME TO TREAT ALZHEIMER'S DISEASE UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2003-12-11 WO disclosed
US-20030165481-A1 Amyloid peptide inactivating enzyme to treat Alzheimer's disease HERSH LOUIS B (US) 2003-09-04 US disclosed
EP-0391953-A1 COMMON ACUTE LYMPHOBLASTIC LEUKEMIA ANTIGEN DANA FARBER CANCER INSTITUTE (US) 1990-10-17 EP disclosed
WO-1989005353-A1 COMMON ACUTE LYMPHOBLASTIC LEUKEMIA ANTIGEN DANA FARBER CANCER INSTITUTE (US) 1989-06-15 WO disclosed