SCHEMBL5956499

SCHEMBL5956499

CC(C)(C)OC(=O)N[C@H]1CCSc2cc(C(=O)Nc3ccnc4c3cnn4C(c3ccccc3)(c3ccccc3)c3ccccc3)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.36
KMT2A Q03164 4/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 2/20 0.34
ACACB O00763 1/20 0.34
ACACA Q13085 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
ADA P00813 2/20 0.33
PSMD14 O00487 1/20 0.33
USP2 O75604 1/20 0.33
PLA2G1B P04054 1/20 0.33
ALPL P05186 1/20 0.33
MMP2 P08253 1/20 0.33
ALPI P09923 1/20 0.33
ALPG P10696 1/20 0.33
PTPN7 P35236 1/20 0.33
DUSP3 P51452 1/20 0.33
BLM P54132 1/20 0.33

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
SCHEMBL5956508 1.00 HDAC1 (0.36) HDAC1KMT2AMEN1LMNAPOLB
SCHEMBL5956649 0.90 IRAK4 (0.33) HDAC1KMT2AMEN1POLBIRAK4
SCHEMBL5956657 0.90 IRAK4 (0.33) HDAC1KMT2AMEN1POLBIRAK4
SCHEMBL5956759 0.88 IRAK4 (0.37) POLBACACBACACAIRAK4
SCHEMBL5956769 0.88 IRAK4 (0.37) POLBACACBACACAIRAK4
SCHEMBL5956485 0.86 HDAC1 (0.34) HDAC1KMT2AMEN1LMNAACACB
SCHEMBL5956686 0.79 MAPK1 (0.33) HDAC1IRAK4ADANTRK1
SCHEMBL5956712 0.78 PIM1 (0.32) IRAK4ADA
SCHEMBL5956688 0.77 IRAK4 (0.36) ACACBACACAIRAK4
SCHEMBL5956503 0.76 TRPV1 (0.36) ACACBACACAADA

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 780/4885KMT2A 1253/4885MEN1 2543/4885

“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.