SCHEMBL5956632

SCHEMBL5956632

O=C(NC1CCSc2cc(C(=O)Nc3ccnc4c3ccn4CO)ccc21)OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.38
DNMT3A Q9Y6K1 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
HDAC1 Q13547 5/20 0.36
HDAC3 O15379 1/20 0.36
HDAC2 Q92769 1/20 0.36
PLAU P00749 1/20 0.35
SIRT5 Q9NXA8 2/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
NPC1 O15118 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
SCHEMBL5956625 1.00 DNMT1 (0.38) DNMT1DNMT3ASMN1; SMN2HDAC1HDAC3
SCHEMBL5956640 0.88 DNMT1 (0.34) DNMT1DNMT3ASMN1; SMN2HDAC1HDAC3
SCHEMBL5956643 0.88 DNMT1 (0.34) DNMT1DNMT3ASMN1; SMN2HDAC1HDAC3
SCHEMBL5956589 0.83 JAK2 (0.45) DNMT1DNMT3ASMN1; SMN2SIRT5JAK2
SCHEMBL5956584 0.83 JAK2 (0.45) DNMT1DNMT3ASMN1; SMN2SIRT5JAK2
SCHEMBL5956725 0.79 POLB (0.51) DNMT1DNMT3ANPC1
SCHEMBL5956868 0.76 KMT2A (0.47) SIRT5KMT2AMEN1NPC1
SCHEMBL5956733 0.76 KMT2A (0.47) SIRT5KMT2AMEN1NPC1
SCHEMBL5956724 0.76 KMT2A (0.47) SIRT5KMT2AMEN1NPC1
Hydrochloric Acid SCHEMBL5956571 0.75 KMT2A (0.47) SIRT5KMT2AMEN1NPC1

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 DNMT1 4188/4885DNMT3A 3905/4885SMN1; SMN2 3300/4885

“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.