SCHEMBL665622

SCHEMBL665622

O=C(NN=C1CCc2cccc(O)c21)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.62
SMN1; SMN2 Q16637 10/20 0.58
MAPT P10636 9/20 0.58
RAB9A P51151 7/20 0.58
NPC1 O15118 6/20 0.58
ALDH1A1 P00352 4/20 0.58
KMT2A Q03164 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
GAA P10253 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
KDM4E B2RXH2 1/20 0.57
TP53 P04637 1/20 0.57
GSTA1 P08263 1/20 0.46
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
RECQL P46063 1/20 0.45
DEPTOR Q8TB45 1/20 0.44
HTT P42858 1/20 0.43

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
SCHEMBL665621 1.00 KDM1A (0.62) KDM1ASMN1; SMN2MAPTRAB9ANPC1
SCHEMBL21098727 0.82 KDM1A (0.53) KDM1ASMN1; SMN2MAPTRAB9ANPC1
SCHEMBL4734168 0.80 SMN1; SMN2 (0.80) SMN1; SMN2MAPTRAB9ANPC1ALDH1A1
SCHEMBL20520189 0.80 SMN1; SMN2 (0.80) SMN1; SMN2MAPTRAB9ANPC1ALDH1A1
SCHEMBL4734171 0.80 SMN1; SMN2 (0.80) SMN1; SMN2MAPTRAB9ANPC1ALDH1A1
SCHEMBL7449894 0.74 SMN1; SMN2 (0.74) SMN1; SMN2MAPTRAB9ANPC1ALDH1A1
SCHEMBL17206744 0.74 SMN1; SMN2 (0.74) SMN1; SMN2MAPTRAB9ANPC1ALDH1A1
SCHEMBL10108255 0.73 KDM1A (0.48) KDM1ASMN1; SMN2MAPTRAB9ANPC1
SCHEMBL9415879 0.71 HSD17B10 (0.50) KDM1ASMN1; SMN2MAPTRAB9ANPC1
SCHEMBL9415876 0.71 HSD17B10 (0.50) KDM1ASMN1; SMN2MAPTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103547153-A Synergistic fungicidal and algicidal compositions including 7-hydroxy-indanone benzoylhydrazones and copper DOW AGROSCIENCES LLC 2014-01-29 CN disclosed
CN-103547153-A Synergistic fungicidal and algicidal compositions including 7-hydroxy-indanone benzoylhydrazones and copper DOW AGROSCIENCES LLC 2014-01-29 CN disclosed
WO-2012024488-A3 SYNERGISTIC FUNGICIDAL AND ALGICIDAL COMPOSITIONS INCLUDING 7-HYDROXY-INDANONE BENZOYLHYDRAZONES AND COPPER DOW AGROSCIENCES LLC (US) 2013-09-12 WO disclosed
EP-2605660-A2 SYNERGISTIC FUNGICIDAL AND ALGICIDAL COMPOSITIONS INCLUDING 7-HYDROXY-INDANONE BENZOYLHYDRAZONES AND COPPER Dow AgroSciences LLC (US) 2013-06-26 EP disclosed
EP-2605660-A2 SYNERGISTIC FUNGICIDAL AND ALGICIDAL COMPOSITIONS INCLUDING 7-HYDROXY-INDANONE BENZOYLHYDRAZONES AND COPPER Dow AgroSciences LLC (US) 2013-06-26 EP disclosed
WO-2012024488-A2 SYNERGISTIC FUNGICIDAL AND ALGICIDAL COMPOSITIONS INCLUDING 7-HYDROXY-INDANONE BENZOYLHYDRAZONES AND COPPER DOW AGROSCIENCES LLC (US) 2012-02-23 WO disclosed
WO-2012024488-A2 SYNERGISTIC FUNGICIDAL AND ALGICIDAL COMPOSITIONS INCLUDING 7-HYDROXY-INDANONE BENZOYLHYDRAZONES AND COPPER DOW AGROSCIENCES LLC (US) 2012-02-23 WO disclosed
US-20120045522-A1 SYNERGISTIC FUNGICIDAL AND ALGICIDAL COMPOSITIONS INCLUDING 7-HYDROXY-INDANONE BENZOYLHYDRAZONES AND COPPER DOW AGROSCIENCES LLC (US) 2012-02-23 US disclosed
US-20120045522-A1 SYNERGISTIC FUNGICIDAL AND ALGICIDAL COMPOSITIONS INCLUDING 7-HYDROXY-INDANONE BENZOYLHYDRAZONES AND COPPER DOW AGROSCIENCES LLC (US) 2012-02-23 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-20120045522-A1 SYNERGISTIC FUNGICIDAL AND ALGICIDAL COMPOSITIONS INCLUDING 7-HYDROXY-INDANONE BENZOYLHYDRAZONES AND COPPER ERG28, CYP3A7, UGT1A7 KDM1A 2027/4885SMN1; SMN2 4723/4885MAPT 2712/4885

“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.