SCHEMBL26020985

SCHEMBL26020985

Cc1cccc2nc3cc(O)c(O)cc3nc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 7/20 0.53
ACHE P22303 1/20 0.52
MAPT P10636 6/20 0.52
RAB9A P51151 4/20 0.52
GAA P10253 4/20 0.52
ALDH1A1 P00352 3/20 0.52
KMT2A Q03164 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
POLB P06746 2/20 0.50
NPC1 O15118 1/20 0.50
LMNA P02545 1/20 0.50
G6PD P11413 1/20 0.50
PKM P14618 1/20 0.50
MYC P01106 1/20 0.46
MAX P61244 1/20 0.46
MGAM O43451 2/20 0.43
SI P14410 2/20 0.43
MGAM2 Q2M2H8 2/20 0.43
MAPK1 P28482 1/20 0.42
CYP1A2 P05177 2/20 0.42

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
SCHEMBL26020993 0.93 MAPT (0.51) NQO2ACHEMAPTRAB9AGAA
SCHEMBL13271195 0.84 ACHE (0.75) NQO2ACHEMAPTRAB9AGAA
SCHEMBL31643056 0.83 RAB9A (0.53) NQO2ACHEMAPTRAB9AGAA
SCHEMBL20475325 0.83 RAB9A (0.53) NQO2ACHEMAPTRAB9AGAA
SCHEMBL13271231 0.82 ACHE (0.65) NQO2ACHEMAPTRAB9AGAA
SCHEMBL183009 0.81 NQO2 (0.57) NQO2ACHEMAPTRAB9AGAA
SCHEMBL20272058 0.81 ACHE (0.69) NQO2ACHEMAPTRAB9AGAA
Bromide SCHEMBL11421481 0.79 NQO2 (0.55) NQO2ACHEMAPTRAB9AGAA
SCHEMBL17483582 0.79 NQO2 (0.68) NQO2MAPTRAB9AGAAALDH1A1
SCHEMBL17483584 0.79 NQO2 (0.68) NQO2MAPTRAB9AGAAALDH1A1

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-11731945-B2 Redox-active compounds and uses thereof CMBLU ENERGY AG (DE) 2023-08-22 US disclosed
EP-4107147-A1 NOVEL PHENAZINE-BASED COMPOUNDS CMBlu Energy AG (DE) 2022-12-28 EP 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-11731945-B2 Redox-active compounds and uses thereof NOX4, NQO1, GPX1 NQO2 519/4885ACHE 498/4885MAPT 1567/4885

“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.