SCHEMBL24650615

SCHEMBL24650615

COc1ccc(COCc2cccc(C(O)c3ccc4c(nnn4C)c3C)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 10/20 0.38
NFE2L2 Q16236 10/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
RAB9A P51151 1/20 0.36
NQO1 P15559 2/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TBXAS1 P24557 1/20 0.33
KDM4E B2RXH2 2/20 0.33
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL29490008 1.00 KEAP1 (0.38) KEAP1NFE2L2SMN1; SMN2NPC1LMNA
SCHEMBL29442705 0.87 NFE2L2 (0.46) KEAP1NFE2L2
SCHEMBL16831673 0.87 NFE2L2 (0.46) KEAP1NFE2L2
SCHEMBL24650660 0.86 NFE2L2 (0.40) KEAP1NFE2L2SMN1; SMN2NPC1LMNA
SCHEMBL24650638 0.85 KEAP1 (0.40) KEAP1NFE2L2SMN1; SMN2NPC1LMNA
SCHEMBL29489994 0.85 KEAP1 (0.40) KEAP1NFE2L2SMN1; SMN2NPC1LMNA
SCHEMBL31470223 0.84 KEAP1 (0.46) KEAP1NFE2L2NQO1
SCHEMBL24650071 0.84 KEAP1 (0.40) KEAP1NFE2L2NQO1
SCHEMBL29442620 0.84 KEAP1 (0.40) KEAP1NFE2L2NQO1
SCHEMBL20313343 0.82 KDM4E (0.42) KEAP1NFE2L2SMN1; SMN2NPC1RAB9A

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-20220259223-A1 BENZOTRIAZOLE DERIVATIVE UBE INDUSTRIES, LTD. (JP) 2022-08-18 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-20220259223-A1 BENZOTRIAZOLE DERIVATIVE KEAP1, NFE2L2, BACH1 KEAP1 1/4885NFE2L2 2/4885SMN1; SMN2 3374/4885

“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.