SCHEMBL9995299

SCHEMBL9995299

O=[N+]([O-])c1ccccc1Nc1ccc(Cl)nc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.59
ALDH1A1 P00352 5/20 0.59
L3MBTL1 Q9Y468 4/20 0.59
TDP1 Q9NUW8 3/20 0.59
CASP7 P55210 1/20 0.59
MAPT P10636 5/20 0.57
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
GAA P10253 1/20 0.57
PKM P14618 1/20 0.57
EPAS1 Q99814 1/20 0.53
MAPK13 O15264 1/20 0.47
MAPK12 P53778 1/20 0.47
MAPK11 Q15759 1/20 0.47
MAPK14 Q16539 1/20 0.47
HTT P42858 3/20 0.47
RAB9A P51151 2/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PIN1 Q13526 1/20 0.45

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
SCHEMBL30079593 1.00 MAPK1 (0.59) MAPK1ALDH1A1L3MBTL1TDP1CASP7
SCHEMBL30079603 0.83 ALDH1A1 (0.68) MAPK1ALDH1A1L3MBTL1TDP1CASP7
SCHEMBL23927051 0.83 ALDH1A1 (0.68) MAPK1ALDH1A1L3MBTL1TDP1CASP7
SCHEMBL30615522 0.82 ALDH1A1 (0.59) MAPK1ALDH1A1L3MBTL1TDP1CASP7
SCHEMBL21463695 0.82 ALDH1A1 (0.59) MAPK1ALDH1A1L3MBTL1TDP1CASP7
SCHEMBL30615647 0.82 ALDH1A1 (0.59) MAPK1ALDH1A1L3MBTL1TDP1CASP7
SCHEMBL21463438 0.82 ALDH1A1 (0.59) MAPK1ALDH1A1L3MBTL1TDP1CASP7
SCHEMBL9995250 0.82 ALDH1A1 (0.49) ALDH1A1L3MBTL1TDP1MAPTMEN1
SCHEMBL11506844 0.81 ALDH1A1 (0.89) MAPK1ALDH1A1L3MBTL1TDP1CASP7
SCHEMBL23927084 0.80 MAPT (0.60) MAPK1ALDH1A1L3MBTL1MAPTMEN1

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 10 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
EP-2582680-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES Novartis AG (CH) 2013-04-24 EP disclosed
US-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2013-04-11 US disclosed
US-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2013-04-11 US disclosed
CN-102947274-A Biphenyl substituted 1, 3-dihydro-benzoimidazol-2-ylideneamine derivatives NOVARTIS AG 2013-02-27 CN disclosed
WO-2011157787-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES NOVARTIS AG (CH) 2011-12-22 WO 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 (2 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-20130090342-A1 BIPHENYL SUBSTITUTED 1,3-DIHYDRO-BENZOIMIDAZOL-2-YLIDENEAMINE DERIVATIVES IGF1R, IGFBP1, IGFBP2 MAPK1 662/4885ALDH1A1 235/4885L3MBTL1 3227/4885
US-20230124087-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS KCNN3, KCNA4, KCNA3 MAPK1 1097/4885ALDH1A1 2760/4885L3MBTL1 711/4885

“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.