SCHEMBL16367363

SCHEMBL16367363

CCC1OC(n2cccc2[N+](=O)[O-])C(O)C1O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 2/20 0.43
MAPT P10636 1/20 0.41
CDA P32320 1/20 0.41
SLC29A1 Q99808 2/20 0.38
SLC28A1 O00337 1/20 0.38
SLC28A2 O43868 1/20 0.38
SLC28A3 Q9HAS3 1/20 0.38
ADK P55263 2/20 0.37
ADORA3 P0DMS8 4/20 0.37
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36
MTOR P42345 1/20 0.36
MDM2 Q00987 1/20 0.36
NCOA1 Q15788 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36

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
SCHEMBL15607846 0.88 MAPT (0.54) SLC5A2MAPTCDASLC29A1SLC28A1
SCHEMBL16367380 0.87 MAPT (0.41) SLC5A2MAPTCDASLC29A1SLC28A1
SCHEMBL16367347 0.82 L3MBTL1 (0.41) SLC5A2ADORA3
SCHEMBL15607860 0.81 MAPT (0.39) MAPTCDAADORA3
SCHEMBL16367416 0.78 LMNA (0.36) MAPTLMNATHRB
SCHEMBL16367403 0.78 L3MBTL1 (0.38) ADORA3
SCHEMBL16367320 0.78 ADORA3 (0.41) MAPTCDASLC29A1SLC28A3ADK
SCHEMBL26554460 0.75 MAPT (0.48) SLC5A2MAPTCDASLC29A1SLC28A1
SCHEMBL11934657 0.73 SLC29A1 (0.42) SLC29A1ADORA3LMNATHRBMTOR
SCHEMBL11934656 0.73 SLC29A1 (0.42) SLC29A1ADORA3LMNATHRBMTOR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150010474-A1 Compounds And Methods For Selective Imaging And/Or Ablation AUCKLAND UNISERVICES LTD (NL) 2015-01-08 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-20150010474-A1 Compounds And Methods For Selective Imaging And/Or Ablation CBR1, CBR3, BLVRB SLC5A2 722/4885MAPT 3982/4885CDA 1189/4885

“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.