SCHEMBL949265

SCHEMBL949265

CCCC(=O)N(CC)CCC(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
ALDH1A1 P00352 3/20 0.34
HPGD P15428 1/20 0.34
HDAC6 Q9UBN7 2/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
ALDH2 P05091 1/20 0.32
CTSK P43235 1/20 0.32
TP53 P04637 1/20 0.31
CA9 Q16790 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP8 P22894 1/20 0.31
CYP1A2 P05177 1/20 0.30

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
SCHEMBL950819 0.88 LMNA (0.36) LMNAL3MBTL1CA12CA1CA7
SCHEMBL949184 0.82 L3MBTL1 (0.35) LMNAL3MBTL1CA12CA1CA7
SCHEMBL948125 0.81 CA12 (0.36) CA12CA1CA7CA14ALDH1A1
SCHEMBL11588393 0.80 MEN1 (0.48) LMNAL3MBTL1CA12CA7CA14
SCHEMBL948980 0.77 CA12 (0.39) CA12CA1CA7CA14ALDH1A1
SCHEMBL22690674 0.77 HDAC6 (0.33) ALDH1A1HPGDHDAC6HDAC1HDAC2
SCHEMBL10446 0.77 ALDH1A1 (0.55) LMNACA12CA1CA7CA14
SCHEMBL12314879 0.77 HDAC6 (0.34) LMNACA12CA1CA7CA14
SCHEMBL18195629 0.76 MEN1 (0.36) L3MBTL1CA12CA1CA7CA14
SCHEMBL13317119 0.75 ALDH1A1 (0.56) LMNACA12CA1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-13 US disclosed
US-20070004736-A1 Imidazole derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-04 US disclosed
EP-1564213-A1 IMIDAZOLE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2005-08-17 EP 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-20070004736-A1 Imidazole derivative, process for producing the same, and use HRH4, F2, HRH2 LMNA 2660/4885L3MBTL1 2949/4885CA12 4269/4885
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE F2, H1-3, CYC1 LMNA 2787/4885L3MBTL1 2955/4885CA12 4499/4885

“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.