SCHEMBL23734151

SCHEMBL23734151

CCC(C)Nc1nc(N)no1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.38
TP53 P04637 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HSP90AA1 P07900 1/20 0.36
CYP3A4 P08684 1/20 0.36
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
CASP1 P29466 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ATM Q13315 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
CTSK P43235 1/20 0.32

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
SCHEMBL23734140 0.80 TRPM8 (0.36) ELANEALDH1A1TDP1KMT2A
SCHEMBL20433304 0.69
SCHEMBL10059800 0.68 L3MBTL1 (0.47) TP53L3MBTL1ALDH1A1HSP90AA1CYP3A4
SCHEMBL23404036 0.63
SCHEMBL11363513 0.63 ELANE (0.41) ELANETP53L3MBTL1ALDH1A1HSP90AA1
SCHEMBL18829560 0.63 L3MBTL1 (0.42) TP53L3MBTL1ALDH1A1HSP90AA1CYP3A4
SCHEMBL2494097 0.62 GAA (0.47) TP53L3MBTL1ALDH1A1HSP90AA1CYP3A4
SCHEMBL24313180 0.61 TLR8 (0.53) TP53L3MBTL1ALDH1A1HSP90AA1CYP3A4
SCHEMBL20079718 0.60 L3MBTL1 (0.42) TP53L3MBTL1ALDH1A1HSP90AA1CYP3A4
SCHEMBL8006674 0.60

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-11083720-B2 Indazole inhibitors of fructokinase (KHK) and methods of use in treating KHK-mediated disorders or diseases REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2021-08-10 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-11083720-B2 Indazole inhibitors of fructokinase (KHK) and methods of use in treating KHK-mediated disorders or diseases KHK, GCK, HK1 ELANE 4089/4885TP53 3151/4885L3MBTL1 1732/4885

“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.