SCHEMBL23927078

SCHEMBL23927078

O=[N+]([O-])c1ccc(Oc2cccc3c2C2(CC2)CO3)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 7/20 0.48
ALDH1A1 P00352 3/20 0.40
MAPT P10636 3/20 0.40
MAPK1 P28482 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
S1PR4 O95977 1/20 0.35
MET P08581 1/20 0.35
HIF1A Q16665 1/20 0.34
RAB9A P51151 1/20 0.34
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL30079780 0.80 MAPK14 (0.36) MEN1KMT2A
SCHEMBL23926986 0.80 MAPK14 (0.36) MEN1KMT2A
SCHEMBL30079808 0.77 HSPB1 (0.48) HSPB1ALDH1A1MAPTL3MBTL1MEN1
SCHEMBL1982056 0.77 HSPB1 (0.48) HSPB1ALDH1A1MAPTL3MBTL1MEN1
SCHEMBL15820188 0.74 HSPB1 (0.80) HSPB1ALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL22712641 0.70 MAPT (0.36) ALDH1A1MAPTGAARAB9APOLB
SCHEMBL22069631 0.70 HSPB1 (0.57) HSPB1ALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL22114132 0.70 HSPB1 (0.63) HSPB1ALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL1583899 0.70 HSPB1 (0.63) HSPB1ALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL23927086 0.70 GABRP (0.36) MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230124087-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS HOFFMANN-LA ROCHE INC. (US) 2023-04-20 US disclosed
EP-4139306-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS F. Hoffmann-La Roche AG (CH) 2023-03-01 EP disclosed
CN-115380032-A KV3 enhancers for the treatment of cognitive disorders 豪夫迈·罗氏有限公司 2022-11-22 CN disclosed
WO-2021214090-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2021-10-28 WO disclosed
EP-3901152-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS F. Hoffmann-La Roche AG (CH) 2021-10-27 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-20230124087-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS KCNN3, KCNA4, KCNA3 HSPB1 2043/4885ALDH1A1 2760/4885MAPT 1023/4885

“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.