SCHEMBL26459348

SCHEMBL26459348

COc1cc(/N=N\c2ccc(S(=O)(=O)O)cc2)ccc1/N=N\c1ccc2c(S(=O)(=O)O)cccc2c1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 2/20 0.60
▸ CYP1A2 P05177 3/20 0.57
▸ ATIC P31939 3/20 0.55
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ THRB P10828 3/20 0.48
▸ TDP1 Q9NUW8 3/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ CYP3A4 P08684 2/20 0.48
▸ HPGD P15428 2/20 0.48
▸ APEX1 P27695 2/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ RECQL P46063 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ BRCA1 P38398 1/20 0.48
▸ BLM P54132 1/20 0.48

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
SCHEMBL14025002 0.87 CYP1A2 (0.64) CYP1A2ATICMEN1KMT2ATHRB
SCHEMBL14025046 0.82 ATIC (0.58) PHLPP2CYP1A2ATICMEN1KMT2A
SCHEMBL29377176 0.78 CYP1A2 (0.69) CYP1A2ATICMEN1KMT2ATHRB
SCHEMBL14418550 0.78 CYP1A2 (0.67) PHLPP2CYP1A2MEN1KMT2ATHRB
SCHEMBL19234932 0.78 CD40 (0.59) PHLPP2MEN1KMT2ATHRBTDP1
SCHEMBL18828469 0.78 CYP1A2 (0.53) PHLPP2CYP1A2ATICMEN1KMT2A
SCHEMBL8844263 0.78 PHLPP2 (0.67) PHLPP2CYP1A2ATICMEN1KMT2A
SCHEMBL8844274 0.78 PHLPP2 (0.67) PHLPP2CYP1A2ATICMEN1KMT2A
SCHEMBL8844279 0.78 PHLPP2 (0.67) PHLPP2CYP1A2ATICMEN1KMT2A
SCHEMBL2987080 0.77 CYP1A2 (0.71) PHLPP2CYP1A2ATICMEN1KMT2A

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-20230127304-A1 NEW INHIBITORS FOR THE KEAP1-NRF2 PROTEIN-PROTEIN INTERACTION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-04-27 — — US disclosed
US-20230127304-A1 NEW INHIBITORS FOR THE KEAP1-NRF2 PROTEIN-PROTEIN INTERACTION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-04-27 — — 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-20230127304-A1 NEW INHIBITORS FOR THE KEAP1-NRF2 PROTEIN-PROTEIN INTERACTION KEAP1, HMOX1, NFE2L2 PHLPP2 1536/4885CYP1A2 3090/4885ATIC 2705/4885

“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.

Send feedback