SCHEMBL4788929

SCHEMBL4788929

CCOC(=O)CCN(C)CCC(=O)OCC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
GAA P10253 2/20 0.52
MGAM O43451 1/20 0.52
SI P14410 1/20 0.52
MGAM2 Q2M2H8 1/20 0.52
CYP1A2 P05177 1/20 0.52
LTA4H P09960 2/20 0.49
ALDH1A1 P00352 4/20 0.48
TRPA1 O75762 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 2/20 0.44
POLB P06746 1/20 0.44
TSHR P16473 1/20 0.44
KDM5A P29375 2/20 0.43
DNM1 Q05193 1/20 0.42

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
SCHEMBL11668776 0.93 MEN1 (0.54) MEN1KMT2AGAAMGAMSI
SCHEMBL20937014 0.91 LTA4H (0.54) MEN1KMT2AGAAMGAMSI
SCHEMBL8632462 0.91 CYP1A2 (0.55) MEN1KMT2AGAAMGAMSI
SCHEMBL9830045 0.91 MEN1 (0.52) MEN1KMT2AGAAMGAMSI
SCHEMBL23583339 0.89 CYP1A2 (0.59) MEN1KMT2AGAAMGAMSI
SCHEMBL11585949 0.89 KDM5A (0.53) MEN1KMT2AGAAMGAMSI
SCHEMBL3903055 0.88 DNM1 (0.50) MEN1KMT2AGAAMGAMSI
SCHEMBL3902356 0.88 MEN1 (0.48) MEN1KMT2AGAAMGAMSI
SCHEMBL4437145 0.88 KDM5A (0.59) MEN1KMT2ACYP1A2LTA4HALDH1A1
SCHEMBL11585402 0.86 KDM5A (0.60) MEN1KMT2ACYP1A2LTA4HALDH1A1

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
US-20200207744-A1 DIMER COMPOUNDS, AND USE IN BINDING TOXIC REPEATS OF RNA EXPANSION THERAPEUTICS, INC. 2020-07-02 US disclosed
US-20200207744-A1 DIMER COMPOUNDS, AND USE IN BINDING TOXIC REPEATS OF RNA EXPANSION THERAPEUTICS, INC. 2020-07-02 US disclosed
US-8003621-B2 Drug carriers NITTO DENKO CORPORATION (JP) 2011-08-23 US disclosed
US-20090105179-A1 DRUG CARRIERS NITTO DENKO CORPORATION (JP) 2009-04-23 US disclosed
WO-2008141057-A1 DEUTERATED PIMAVANSERIN 1- (4-FLU0R0BENZYL) -3- (4-ISOBUTOXYBENZYL) -1- ( L-METHYL-PIPERIDIN-4-YL) -UREA AUSPEX PHARMACEUTICALS, INC. (US) 2008-11-20 WO disclosed
US-20080280886-A1 SUBSTITUTED UREAS AUSPEX PHARMACEUTICALS, INC. (US) 2008-11-13 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 (3 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-20200207744-A1 DIMER COMPOUNDS, AND USE IN BINDING TOXIC REPEATS OF RNA HNRNPH1, HNRNPUL2, HNRNPH3 MEN1 1977/4885KMT2A 900/4885GAA 1486/4885
US-20090105179-A1 DRUG CARRIERS HDGF, FIBP, SLC47A2 MEN1 2244/4885KMT2A 4715/4885GAA 634/4885
US-20080280886-A1 SUBSTITUTED UREAS HTR4, HTR5A, HTR6 MEN1 4078/4885KMT2A 2286/4885GAA 2909/4885

“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.