SCHEMBL5322277

SCHEMBL5322277

C[C@H](Nc1c(O)c(O)c(O)c(O)c1O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
ALDH1A1 P00352 3/20 0.33
BBOX1 O75936 2/20 0.32
EGLN1 Q9GZT9 2/20 0.32
FTO Q9C0B1 1/20 0.32
MME P08473 3/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GRM1 Q13255 1/20 0.32
MCL1 Q07820 1/20 0.31
ADAMTS4 O75173 1/20 0.31
RAB9A P51151 1/20 0.31
ACE P12821 1/20 0.31
CPA1 P15085 1/20 0.31
ACE2 Q9BYF1 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
SCHEMBL5322290 1.00 TP53 (0.33) TP53ALDH1A1BBOX1EGLN1FTO
SCHEMBL8496697 0.76 ALDH1A1 (0.39) TP53ALDH1A1MMEKDM4EHPGD
SCHEMBL11687819 0.76 ALDH1A1 (0.39) TP53ALDH1A1MMEKDM4EHPGD
SCHEMBL4316481 0.74 SMN1; SMN2 (0.36) TP53ALDH1A1MMELMNA
SCHEMBL7584559 0.74 KDM4C (0.34) TP53ALDH1A1BBOX1EGLN1FTO
SCHEMBL4316479 0.74 SMN1; SMN2 (0.36) TP53ALDH1A1MMELMNA
SCHEMBL5319455 0.74 CA12 (0.46) ALDH1A1KDM4ELMNAHPGDHSD17B10
SCHEMBL5319450 0.74 CA12 (0.46) ALDH1A1KDM4ELMNAHPGDHSD17B10
SCHEMBL1422066 0.73 CYTH2 (0.42) ALDH1A1MCL1
SCHEMBL1422067 0.73 CYTH2 (0.42) ALDH1A1MCL1

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-20070258899-A1 Diagnostic and therapeutic agents KARYON-CTT LTD (FI) 2007-11-08 US disclosed
WO-2007113385-A1 DIAGNOSTIC AND THERAPEUTIC AGENTS KARYON-CTT LTD (FI) 2007-10-11 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-20070258899-A1 Diagnostic and therapeutic agents YBX1, MLX, TPX2 TP53 99/4885ALDH1A1 4879/4885BBOX1 3290/4885

“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.