SCHEMBL1753584

SCHEMBL1753584

CC(C)(C)Nc1ccc(COC(=O)Nc2ccc(C=C(COC(=O)Nc3ccc(C=C(COC(=O)C(C)(C)C)COC(=O)C(C)(C)C)cc3)COC(=O)Nc3ccc(C=C(COC(=O)C(C)(C)C)COC(=O)C(C)(C)C)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NAMPT P43490 1/20 0.39
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
POLB P06746 1/20 0.37
KDM1A O60341 2/20 0.35
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35

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
SCHEMBL1753759 0.99 MEN1 (0.46) MEN1KMT2ASMN1; SMN2L3MBTL1NAMPT
SCHEMBL1753754 0.88 MEN1 (0.44) MEN1KMT2ASMN1; SMN2L3MBTL1NAMPT
SCHEMBL1753516 0.88 MEN1 (0.44) MEN1KMT2ASMN1; SMN2L3MBTL1NAMPT
SCHEMBL1753510 0.86 MEN1 (0.45) MEN1KMT2ASMN1; SMN2L3MBTL1NAMPT
SCHEMBL1753753 0.86 MEN1 (0.45) MEN1KMT2ASMN1; SMN2L3MBTL1NAMPT
SCHEMBL13596295 0.85 MEN1 (0.56) MEN1KMT2ASMN1; SMN2L3MBTL1NAMPT
SCHEMBL1753513 0.80 RXFP1 (0.37) MEN1KMT2ASMN1; SMN2L3MBTL1MAPT
SCHEMBL13410952 0.78 MEN1 (0.44) MEN1KMT2ASMN1; SMN2L3MBTL1NAMPT
SCHEMBL13410931 0.78 MEN1 (0.44) MEN1KMT2ASMN1; SMN2L3MBTL1NAMPT
SCHEMBL13410939 0.78 NPC1 (0.44) MEN1KMT2ASMN1; SMN2L3MBTL1NAMPT

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-8158590-B2 Triazole-containing releasable linkers, conjugates thereof, and methods of preparation SYNTARGA B.V. (NL) 2012-04-17 US disclosed
US-20080311136-A1 Triazole-Containing Releasable Linkers, Conjugates Thereof, and Methods of Preparation BYONDIS B.V. (NL) 2008-12-18 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-20080311136-A1 Triazole-Containing Releasable Linkers, Conjugates Thereof, and Methods of Preparation PAICS, CD44, TRIM33 MEN1 581/4885KMT2A 2312/4885SMN1; SMN2 3528/4885

“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.