SCHEMBL16367292

SCHEMBL16367292

Cc1ccc(S(=O)(=O)OCC(O)Cn2ccnc2[N+](=O)[O-])cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
GAA P10253 1/20 0.41
CA12 O43570 5/20 0.41
CA1 P00915 5/20 0.41
CA2 P00918 5/20 0.41
CA9 Q16790 5/20 0.41
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 3/20 0.39
LMNA P02545 1/20 0.39
THRB P10828 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
OPRK1 P41145 1/20 0.36
USP2 O75604 1/20 0.36
TSHR P16473 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
SCHEMBL16367296 0.90 KMT2A (0.47) KMT2AGAACA12CA1CA2
SCHEMBL16367290 0.84 KMT2A (0.60) KMT2ACA12CA1CA2CA9
SCHEMBL16800250 0.81 KMT2A (0.51) KMT2AGAACA12CA1CA2
SCHEMBL28634383 0.81 CA12 (0.49) KMT2ACA12CA1CA2CA9
SCHEMBL16367377 0.80 ALDH1A1 (0.39) KMT2AGAAALDH1A1MAPTHTT
SCHEMBL5536543 0.79 PKM (0.42) KMT2AGAAALDH1A1MAPTHTT
SCHEMBL5536554 0.79 PKM (0.42) KMT2AGAAALDH1A1MAPTHTT
SCHEMBL16800264 0.79 KMT2A (0.48) KMT2AGAACA12CA1CA2
Misonidazole SCHEMBL51943 0.79 KMT2A (0.66) KMT2ACA12CA1CA2CA9
SCHEMBL15607876 0.78 ALDH1A1 (0.37) KMT2AGAAALDH1A1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2810926-B1 METHOD FOR PREPARING FLUORINE-18 ELUENT WITH ADJUSTED PH, AND METHOD FOR LABELLING FLUORINE-18 USING SAME ASAN FOUND (KR) 2017-06-21 EP disclosed
US-20150010474-A1 Compounds And Methods For Selective Imaging And/Or Ablation AUCKLAND UNISERVICES LTD (NL) 2015-01-08 US disclosed
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 KMT2A 2366/4885GAA 1181/4885CA12 300/4885

“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.