SCHEMBL5956485

SCHEMBL5956485

CC(C)(C)OC(=O)N[C@H]1CCS(=O)(=O)c2cc(C(=O)Nc3ccnc4c3cnn4C(c3ccccc3)(c3ccccc3)c3ccccc3)ccc21

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.34
MAPK1 P28482 1/20 0.34
LMNA P02545 1/20 0.34
IRAK4 Q9NWZ3 2/20 0.33
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33
ADA P00813 3/20 0.32
RAF1 P04049 2/20 0.32
TRPV1 Q8NER1 1/20 0.32
NAMPT P43490 1/20 0.32
IRAK1 P51617 1/20 0.31
MEN1 O00255 1/20 0.31
PABPC1 P11940 1/20 0.31
KMT2A Q03164 1/20 0.31
EIF4H Q15056 1/20 0.31
RORC P51449 1/20 0.31
NTRK1 P04629 1/20 0.31
KIT P10721 1/20 0.31

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
SCHEMBL5956686 0.90 MAPK1 (0.33) HDAC1MAPK1IRAK4ADANTRK1
SCHEMBL5956688 0.88 IRAK4 (0.36) MAPK1IRAK4ACACBACACARORC
SCHEMBL5956499 0.86 HDAC1 (0.36) HDAC1LMNAIRAK4ACACBACACA
SCHEMBL5956508 0.86 HDAC1 (0.36) HDAC1LMNAIRAK4ACACBACACA
SCHEMBL5956712 0.85 PIM1 (0.32) IRAK4ADATRPV1
SCHEMBL5956649 0.79 IRAK4 (0.33) HDAC1MAPK1IRAK4ADAMEN1
SCHEMBL5956657 0.79 IRAK4 (0.33) HDAC1MAPK1IRAK4ADAMEN1
SCHEMBL5956759 0.77 IRAK4 (0.37) IRAK4ACACBACACA
SCHEMBL5956769 0.77 IRAK4 (0.37) IRAK4ACACBACACA
SCHEMBL5956503 0.75 TRPV1 (0.36) ACACBACACAADATRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1270570-B1 AMIDE COMPOUNDS AND USE THEREOF MITSUBISHI PHARMA CORP (JP) 2006-05-31 EP disclosed
US-6933305-B2 Amide compounds and use thereof MITSUBISHI PHARMA CORPORATION (JP) 2005-08-23 US disclosed
US-20030158413-A1 Amide compounds and use thereof MITSUBISHI PHARMA CORPORATION (JP) 2003-08-21 US disclosed
EP-1270570-A1 AMIDE COMPOUNDS AND USE THEREOF Mitsubishi Pharma Corporation (JP) 2003-01-02 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 (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-20030158413-A1 Amide compounds and use thereof ROCK2, ROCK1, RHOT2 HDAC1 780/4885MAPK1 128/4885LMNA 3962/4885

“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.