SCHEMBL3486818

SCHEMBL3486818

CC(C)(C)OC(=O)Nc1ccc(C(=O)NCC(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.54
CD274 Q9NZQ7 1/20 0.54
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
HIF1A Q16665 1/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
HDAC1 Q13547 3/20 0.49
HDAC6 Q9UBN7 2/20 0.49
HDAC3 O15379 1/20 0.49
HDAC10 Q969S8 1/20 0.49
CYP17A1 P05093 2/20 0.48
ATM Q13315 1/20 0.47
PTPN11 Q06124 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
POLB P06746 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45

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
SCHEMBL2651542 0.86 CD274 (0.57) NAMPTCD274HDAC1HDAC6HDAC3
SCHEMBL5925523 0.85 NAMPT (0.56) NAMPTCD274HDAC1HDAC6CYP17A1
SCHEMBL21661749 0.83 NAMPT (0.72) NAMPTCD274MAPTHDAC6HDAC3
SCHEMBL14279941 0.83 CD274 (0.60) NAMPTCD274HDAC1HDAC6HDAC3
SCHEMBL21661941 0.83 HDAC6 (0.63) NAMPTCD274HDAC1HDAC6HDAC3
SCHEMBL5736115 0.83 HDAC1 (0.60) NAMPTMAPTKDM4EHIF1ASLC22A6
SCHEMBL9300423 0.82 CYP17A1 (0.51) NAMPTMAPTHDAC1HDAC6HDAC3
SCHEMBL8879852 0.82 NAMPT (0.59) NAMPTCD274MAPTKDM4EHIF1A
SCHEMBL30552299 0.82 NAMPT (0.53) NAMPTCD274HDAC1HDAC6CYP17A1
SCHEMBL22461360 0.81 NAMPT (0.65) NAMPTCD274MAPTHDAC6HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012419-B2 Methods and compositions related to eosinophil regulation UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2015-04-21 US disclosed
US-9012419-B2 Methods and compositions related to eosinophil regulation UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2015-04-21 US disclosed
US-9012419-B2 Methods and compositions related to eosinophil regulation UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2015-04-21 US disclosed
US-20100016410-A1 Methods and Compositions Related to Eosinophil Regulation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-01-21 US disclosed
US-20100016410-A1 Methods and Compositions Related to Eosinophil Regulation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-01-21 US disclosed
US-20100016410-A1 Methods and Compositions Related to Eosinophil Regulation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-01-21 US disclosed
US-20070043093-A1 Glucagon-like peptide-1 receptor agonists, the preparation and the use of the same SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2007-02-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070043093-A1 Glucagon-like peptide-1 receptor agonists, the preparation and the use of the same GLP1R, GCGR, GIPR NAMPT 2650/4885CD274 737/4885MAPT 4725/4885
US-20100016410-A1 Methods and Compositions Related to Eosinophil Regulation EPX, CCL11, ELANE NAMPT 2976/4885CD274 3344/4885MAPT 4831/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.