SCHEMBL7550451

SCHEMBL7550451

CC(C)CC(NC(=O)CNC(=O)C(CC(C)C)NC(=O)C1CCCN1C(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.68
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
ALDH1A1 P00352 1/20 0.44
MEN1 O00255 4/20 0.43
MAPK1 P28482 1/20 0.42
LMNA P02545 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NPC1 O15118 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CMA1 P23946 2/20 0.40
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40

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
SCHEMBL7152157 1.00 KMT2A (0.68) KMT2APOLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL30487448 0.92 KMT2A (0.73) KMT2APOLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL7146326 0.92 KMT2A (0.58) KMT2APOLBSMN1; SMN2
SCHEMBL7551114 0.92 KMT2A (0.58) KMT2APOLBSMN1; SMN2
SCHEMBL10788732 0.90 KMT2A (0.65) KMT2APOLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL10788724 0.90 KMT2A (0.65) KMT2APOLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL29359618 0.90 KMT2A (0.78) KMT2APOLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL31186018 0.90 KMT2A (0.78) KMT2APOLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL10794138 0.88 KMT2A (0.62) KMT2APOLBSMN1; SMN2ALDH1A1MEN1
SCHEMBL10794129 0.88 KMT2A (0.62) KMT2APOLBSMN1; SMN2ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020173452-A1 Cytostatic-glycoconjugates having specifically cleavable linking units BAYER AKTIENGESELLSCHAFT (DE) 2002-11-21 US disclosed
WO-2002051862-A2 CYTOSTATIC-GLYCOCONJUGATES HAVING SPECIFICALLY CLEAVABLE PEPTIDICLINKING UNITS BAYER AKTIENGESELLSCHAFT (DE) 2002-07-04 WO disclosed
EP-1219634-A1 Cytostatic-glycoconjugates having specifically cleavable peptidic linking units Bayer Aktiengesellschaft (DE) 2002-07-03 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-20020173452-A1 Cytostatic-glycoconjugates having specifically cleavable linking units CTSE, CTSL, CTSZ KMT2A 3269/4885POLB 2127/4885SMN1; SMN2 1829/4885

“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.