SCHEMBL7057211

SCHEMBL7057211

CCOC(=O)/C(CN1CCC(O)CC1)=N\O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
MAPT P10636 3/20 0.38
GAA P10253 3/20 0.36
PKM P14618 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
TERT O14746 1/20 0.33
USP14 P54578 1/20 0.33
MAPK8 P45983 1/20 0.33
MAPK9 P45984 1/20 0.33
USP2 O75604 1/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33

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
SCHEMBL7057215 1.00 ALDH1A1 (0.41) ALDH1A1HTTKDM4ESMN1; SMN2APOBEC3A
SCHEMBL7054419 0.83 ALDH1A1 (0.60) ALDH1A1HTTKDM4ESMN1; SMN2APOBEC3A
SCHEMBL7054422 0.83 ALDH1A1 (0.60) ALDH1A1HTTKDM4ESMN1; SMN2APOBEC3A
SCHEMBL7058008 0.80 TSHR (0.47) ALDH1A1HTTKDM4ESMN1; SMN2MAPT
SCHEMBL7058013 0.80 TSHR (0.47) ALDH1A1HTTKDM4ESMN1; SMN2MAPT
SCHEMBL7052338 0.79 ALDH1A1 (0.41) ALDH1A1HTTKDM4ESMN1; SMN2APOBEC3A
SCHEMBL7052334 0.79 ALDH1A1 (0.41) ALDH1A1HTTKDM4ESMN1; SMN2APOBEC3A
SCHEMBL6642453 0.77 TDP1 (0.41) ALDH1A1KDM4ESMN1; SMN2MAPTGAA
SCHEMBL303938 0.74 KDM4E (0.40) ALDH1A1KDM4ESMN1; SMN2MAPTGAA
SCHEMBL7058622 0.72 MEN1 (0.54) ALDH1A1MAPTGAAPKM

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-6608196-B2 Structurally diverse; parallel approach GALILEO PHARMACEUTICALS, INC. 2003-08-19 US disclosed
US-20030100750-A1 Process for solid supported synthesis of pyruvate-derived compounds EDISON PHARMACEUTICALS, INC. 2003-05-29 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-20030100750-A1 Process for solid supported synthesis of pyruvate-derived compounds PC, PDK4, PDK1 ALDH1A1 3046/4885HTT 2689/4885KDM4E 1736/4885

“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.