SCHEMBL901118

SCHEMBL901118

Cc1cccc(C)c1NC(=O)C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
PDK1 Q15118 1/20 0.53
PDK2 Q15119 1/20 0.53
PDK3 Q15120 1/20 0.53
PDK4 Q16654 1/20 0.53
ALDH1A1 P00352 2/20 0.52
HTT P42858 1/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 2/20 0.50
NFKB1 P19838 1/20 0.50
CYP2C19 P33261 1/20 0.50
LMNA P02545 4/20 0.49
USP2 O75604 1/20 0.49
POLB P06746 4/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MAPT P10636 3/20 0.47
SCN3A Q9NY46 3/20 0.47
SCN1A P35498 2/20 0.47

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
SCHEMBL14866056 0.87 PDK1 (0.70) L3MBTL1PDK1PDK2PDK3PDK4
SCHEMBL20362848 0.87 PDK1 (0.50) L3MBTL1PDK1PDK2PDK3PDK4
SCHEMBL28277440 0.86 PDK1 (0.55) L3MBTL1PDK1PDK2PDK3PDK4
SCHEMBL18485510 0.86 PDK1 (0.51) L3MBTL1PDK1PDK2PDK3PDK4
SCHEMBL14057915 0.86 POLB (0.57) L3MBTL1PDK1PDK2PDK3PDK4
SCHEMBL11437102 0.84 PDK1 (0.50) L3MBTL1PDK1PDK2PDK3PDK4
SCHEMBL25095439 0.82 PDK1 (0.55) L3MBTL1PDK1PDK2PDK3PDK4
SCHEMBL6357501 0.80 PDK1 (0.80) PDK1PDK2PDK3PDK4
SCHEMBL30525296 0.79 CETP (0.59) L3MBTL1ALDH1A1HTTMEN1KMT2A
SCHEMBL4333871 0.78 POLB (0.60) L3MBTL1ALDH1A1HTTMEN1KMT2A

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
WO-2012040853-A1 GROUP 5 METAL COMPLEXES USEFUL FOR AMINE FUNCTIONALIZATION AND SYNTHETIC PROCESS FOR MANUFACTURE THEREOF THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2012-04-05 WO 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

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

For each of this compound's patents that has machine-readable text (1 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-20100016410-A1 Methods and Compositions Related to Eosinophil Regulation EPX, CCL11, ELANE L3MBTL1 4209/4885PDK1 4309/4885PDK2 4224/4885

“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.