SCHEMBL271111

SCHEMBL271111

CC(=O)c1ccc(CCC(=O)NCCOCCOCCNC(=O)CCCC(=O)NCCCCC2(c3ccccc3)C(=O)NC(=O)NC2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MMP2 P08253 3/20 0.41
MMP9 P14780 3/20 0.41
MMP3 P08254 2/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 1/20 0.39
MMP13 P45452 2/20 0.38
MMP8 P22894 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
EPOR P19235 1/20 0.36
KDM1A O60341 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36

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
SCHEMBL271155 0.91 SMN1; SMN2 (0.44) MMP2MMP9MMP3MMP13MMP8
SCHEMBL265305 0.86 LMNA (0.36) LMNAKDM4EMMP2MMP9MMP3
SCHEMBL271378 0.84 MMP2 (0.54) MMP2MMP9MMP3HPGDMEN1
SCHEMBL370702 0.84 MMP2 (0.45) LMNAMMP2MMP9MMP3HPGD
SCHEMBL13889219 0.83 NAMPT (0.33) LMNAKDM4EMMP2MMP9MMP3
SCHEMBL12456519 0.82 MMP2 (0.43) LMNAMMP2MMP9MMP3HPGD
SCHEMBL271537 0.81 MMP2 (0.51) LMNAKDM4EMMP2MMP9MMP3
SCHEMBL300808 0.80 SMN1; SMN2 (0.47) MMP2MMP9MMP3MMP13MMP8
SCHEMBL300807 0.80 MMP2 (0.49) MMP2MMP9MMP3HPGDMEN1
SCHEMBL265306 0.79 MMP2 (0.33) LMNAKDM4EMMP2MMP9MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133743-B2 Phenobarbital derivatives useful in immunoassay ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2012-03-13 US disclosed
US-20090104713-A1 Phenobarbital derivatives useful in immunoassay ROCHE DIAGNOSTICS OPERATIONS, INC. 2009-04-23 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-20090104713-A1 Phenobarbital derivatives useful in immunoassay PGM2, CYP4F2, CYP3A7 LMNA 2314/4885KDM4E 471/4885MMP2 1480/4885

“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.