SCHEMBL5831471

SCHEMBL5831471

NCC(CO)OCN1C(=O)NC(=O)C(Cc2ccccc2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.39
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36
GLA P06280 1/20 0.36
HTT P42858 1/20 0.36
GAA P10253 2/20 0.34
POLB P06746 1/20 0.33
GSK3B P49841 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
IDO1 P14902 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HDAC1 Q13547 1/20 0.32
KDM4C Q9H3R0 2/20 0.31
HSD17B10 Q99714 1/20 0.31
HTR1A P08908 1/20 0.31

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
SCHEMBL5831940 0.93 EP300 (0.43) EP300ALDH1A1KDM4EMAPTGLA
SCHEMBL7525758 0.81 EP300 (0.43) EP300ALDH1A1KDM4EMAPTGLA
SCHEMBL29482405 0.80 CYP4F2 (0.41) MEN1KMT2ASMN1; SMN2KDM4C
SCHEMBL21724393 0.80 CYP4F2 (0.41) MEN1KMT2ASMN1; SMN2KDM4C
SCHEMBL9482802 0.79 EP300 (0.41) EP300ALDH1A1KDM4EMAPTGLA
SCHEMBL5831498 0.77 EP300 (0.43) EP300ALDH1A1KDM4EMAPTGLA
SCHEMBL18254504 0.75 EP300 (0.49) EP300ALDH1A1KDM4EMAPTGLA
SCHEMBL7844009 0.73 EP300 (0.66) EP300ALDH1A1GAAPOLBGSK3B
SCHEMBL17717907 0.71 EP300 (0.48) EP300ALDH1A1KDM4EMAPTGLA
SCHEMBL17717901 0.71 EP300 (0.50) EP300ALDH1A1KDM4EMAPTGLA

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-6992072-B2 Combating side-effects PHARMA NORD APS (DK) 2006-01-31 US disclosed
US-20040138157-A1 Combating side-effects PHARMA NORD APS (DK) 2004-07-15 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-20040138157-A1 Combating side-effects POLRMT, TK2, POLM EP300 4369/4885ALDH1A1 848/4885KDM4E 3639/4885

“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.