SCHEMBL3078265

SCHEMBL3078265

C=CC(OC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C)[C@H]1O[C@@H](n2cc(Br)c(=O)[nH]c2=O)C[C@@H]1Cl

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
TDP1 Q9NUW8 1/20 0.31
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3082515 0.97 KMT2A (0.35) KMT2AMEN1TDP1ALDH1A1POLB
SCHEMBL17135542 0.88 ABCG2 (0.37) KMT2AMEN1POLB
SCHEMBL3082521 0.85 KMT2A (0.36) KMT2AMEN1TDP1ALDH1A1POLB
Trifluoroacetic Acid SCHEMBL3089959 0.85
SCHEMBL3078293 0.84 TK2 (0.35) KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL3084969 0.82 KMT2A (0.37) KMT2AMEN1TDP1ALDH1A1POLB
SCHEMBL17135516 0.80 MEN1 (0.33) KMT2AMEN1TDP1
Trifluoroacetic Acid SCHEMBL3085583 0.78 SMN1; SMN2 (0.32) KMT2AALDH1A1POLBSMN1; SMN2
SCHEMBL3078268 0.75 TK1 (0.46) KMT2AMEN1
SCHEMBL3066218 0.72 ALDH1A1 (0.39) KMT2AALDH1A1POLBSMN1; SMN2

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
EP-2054406-B1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY RESPROTECT GMBH (DE) 2015-10-07 EP disclosed
US-8492537-B2 Nucleosides for suppressing or reducing the development of resistance in cytostatic therapy RESPROTECT GMBH (DE) 2013-07-23 US disclosed
US-20100227834-A1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY RESprotech GmbH (DE) 2010-09-09 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-20100227834-A1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY TYMP, ENTPD5, NTPCR KMT2A 2577/4885MEN1 1265/4885TDP1 293/4885

“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.