SCHEMBL15428010

SCHEMBL15428010

Cc1ccc(NC(=O)C(C)(C)C)c(C=O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
KDM4E B2RXH2 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CETP P11597 1/20 0.41
PDK1 Q15118 1/20 0.41
PDK2 Q15119 1/20 0.41
PDK3 Q15120 1/20 0.41
PDK4 Q16654 1/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTT P42858 2/20 0.40
ERN1 O75460 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL15427919 0.87 PDK1 (0.44) SRCL3MBTL1ALDH1A1LMNAKDM4E
SCHEMBL15428158 0.84 L3MBTL1 (0.43) L3MBTL1ALDH1A1LMNAKDM4ENPSR1
SCHEMBL19670946 0.83 ERN1 (0.46) L3MBTL1ALDH1A1KDM4ENPSR1GAA
SCHEMBL2885051 0.81 SRC (0.47) SRCALDH1A1LMNAKDM4ETDP1
SCHEMBL29955390 0.81 SRC (0.47) SRCALDH1A1LMNAKDM4ETDP1
SCHEMBL29956441 0.81 HPGD (0.46) SRCALDH1A1LMNAKDM4ENPSR1
SCHEMBL3292146 0.81 HPGD (0.46) SRCALDH1A1LMNAKDM4ENPSR1
SCHEMBL6094043 0.80 TACR1 (0.42) L3MBTL1ALDH1A1LMNAKDM4ENPSR1
SCHEMBL8845083 0.79 ALDH1A1 (0.45) L3MBTL1ALDH1A1LMNAKDM4ENPSR1
SCHEMBL15427825 0.78 CETP (0.57) L3MBTL1ALDH1A1LMNAKDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9837622-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-05 US disclosed
US-9837622-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-05 US disclosed
US-20150263297-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-09-17 US disclosed
US-20150263297-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-09-17 US disclosed
WO-2014008982-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2014-01-16 WO 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-20150263297-A1 Metal Complexes SOD1, AP1M1, AP3M1 SRC 1931/4885L3MBTL1 3160/4885ALDH1A1 3721/4885

“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.