SCHEMBL4440235

SCHEMBL4440235

C=C(C)C(=O)OCC(=O)NCCN1CCNC1=O.C=CC(=O)OCC(=O)NCCN1CCNC1=O.C=CC(=O)OCC(=O)NCCN1CCNC1=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 4/20 0.39
LMNA P02545 2/20 0.39
CREBBP Q92793 1/20 0.38
HPGDS O60760 1/20 0.36
KRAS P01116 1/20 0.34
MEN1 O00255 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FPR3 P25089 4/20 0.33
FPR2 P25090 4/20 0.33
ENPP2 Q13822 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL513439 0.92 KMT2A (0.48) KMT2ARAB9AALDH1A1KDM4ELMNA
SCHEMBL1626503 0.91 RAB9A (0.46) KMT2ARAB9AALDH1A1KDM4ELMNA
SCHEMBL3680500 0.91 RAB9A (0.46) KMT2ARAB9AALDH1A1KDM4ELMNA
SCHEMBL4991711 0.90 RAB9A (0.36) KMT2ARAB9AALDH1A1KDM4ELMNA
SCHEMBL11339800 0.85 KMT2A (0.41) KMT2ARAB9AALDH1A1KDM4ELMNA
SCHEMBL11332040 0.84 KMT2A (0.39) KMT2ARAB9AALDH1A1KDM4ELMNA
SCHEMBL21485042 0.80 KMT2A (0.47) KMT2ARAB9AALDH1A1KDM4ELMNA
SCHEMBL1628845 0.77 KMT2A (0.49) KMT2ARAB9AALDH1A1KDM4ELMNA
SCHEMBL138215 0.75 THRB (0.41) KMT2ARAB9AALDH1A1KDM4ELMNA
SCHEMBL9470924 0.74 ALDH1A1 (0.33) KMT2AALDH1A1KDM4ELMNASMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2120553-B1 PRODUCTION OF SOLID SOLUTIONS OF PESTICIDES BY SHORT TERM SUPERHEATING AND RAPID DRYING BASF SE (DE) 2014-05-28 EP disclosed
EP-2120553-A2 PRODUCTION OF SOLID SOLUTIONS OF PESTICIDES BY SHORT TERM SUPERHEATING AND RAPID DRYING BASF SE (DE) 2009-11-25 EP disclosed
US-20080167189-A1 Polymer Compositions and Their Use in the Production of Active or Effective Ingredient Compositions BASF AKTIENGESELLSCHAFT (DE) 2008-07-10 US disclosed
WO-2008065051-A2 PRODUCTION OF SOLID SOLUTIONS OF PESTICIDES BY SHORT TERM SUPERHEATING AND RAPID DRYING BASF SE (DE) 2008-06-05 WO disclosed
EP-1851262-A1 POLYMER COMPOSITIONS AND THEIR USE IN THE PRODUCTION OF ACTIVE OR EFFECTIVE INGREDIENT COMPOSITIONS BASF AKTIENGESELLSCHAFT (DE) 2007-11-07 EP disclosed
WO-2006084680-A1 POLYMER COMPOSITIONS AND THEIR USE IN THE PRODUCTION OF ACTIVE OR EFFECTIVE INGREDIENT COMPOSITIONS BASF AKTIENGESELLSCHAFT (DE) 2006-08-17 WO 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-20080167189-A1 Polymer Compositions and Their Use in the Production of Active or Effective Ingredient Compositions GANC, PHOSPHO1, PGLS KMT2A 3150/4885RAB9A 3121/4885ALDH1A1 4263/4885

“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.