SCHEMBL21076290

SCHEMBL21076290

CC(CO)N1CCOCCOCCN(CCO)CCOCC1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.63
KDM4E B2RXH2 2/20 0.63
USP2 O75604 1/20 0.37
GLA P06280 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
KEAP1 Q14145 1/20 0.36
HSD17B10 Q99714 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.34
DUSP3 P51452 1/20 0.34
SYK P43405 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL295997 0.85 KMT2A (0.41) ALDH1A1KDM4EUSP2SMN1; SMN2GAA
SCHEMBL14856607 0.85 KMT2A (0.41) ALDH1A1KDM4EUSP2SMN1; SMN2GAA
SCHEMBL19285734 0.85 KMT2A (0.41) ALDH1A1KDM4EUSP2SMN1; SMN2GAA
SCHEMBL6026163 0.81 ALDH1A1 (0.43) ALDH1A1KDM4EHSD17B10POLBGAA
SCHEMBL12958952 0.81 KDM4E (0.95) ALDH1A1KDM4EUSP2GLACA12
SCHEMBL16604261 0.81 KDM4E (0.95) ALDH1A1KDM4EUSP2GLACA12
SCHEMBL371210 0.81 KDM4E (0.95) ALDH1A1KDM4EUSP2GLACA12
SCHEMBL11200585 0.81 KDM4E (0.95) ALDH1A1KDM4EUSP2GLACA12
Methyl Alcohol SCHEMBL27850055 0.79 KDM4E (0.82) ALDH1A1KDM4EUSP2GLACA12
SCHEMBL25262333 0.79 KDM4E (0.90) ALDH1A1KDM4EUSP2GLACA12

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-10933139-B2 Conjugated lipomers and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2021-03-02 US disclosed
US-20190167795-A1 CONJUGATED LIPOMERS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2019-06-06 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 (2 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-20190167795-A1 CONJUGATED LIPOMERS AND USES THEREOF EZH2, LIPC, PUF60 ALDH1A1 1831/4885KDM4E 812/4885USP2 2138/4885
US-10933139-B2 Conjugated lipomers and uses thereof EZH2, LIPC, PUF60 ALDH1A1 1831/4885KDM4E 812/4885USP2 2138/4885

“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.