SCHEMBL684535

SCHEMBL684535

C/C(=N\NC(=O)c1cccc(I)c1)c1ccccc1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.65
MTOR P42345 4/20 0.64
KDM4E B2RXH2 5/20 0.57
RAB9A P51151 6/20 0.55
SMN1; SMN2 Q16637 5/20 0.55
MEN1 O00255 3/20 0.55
GAA P10253 3/20 0.55
KMT2A Q03164 3/20 0.55
MAPT P10636 3/20 0.55
HTT P42858 2/20 0.55
ALDH1A1 P00352 2/20 0.55
PKM P14618 1/20 0.55
MCL1 Q07820 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
GSTA1 P08263 1/20 0.52
NPC1 O15118 5/20 0.52
LMNA P02545 1/20 0.52
CTDSP1 Q9GZU7 1/20 0.51
HPGD P15428 1/20 0.50

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
SCHEMBL12316802 1.00 KDM1A (0.65) KDM1AMTORKDM4ERAB9ASMN1; SMN2
SCHEMBL1165032 0.87 MTOR (0.74) KDM1AMTORKDM4ERAB9ASMN1; SMN2
SCHEMBL1165031 0.87 MTOR (0.74) KDM1AMTORKDM4ERAB9ASMN1; SMN2
SCHEMBL683725 0.85 KDM1A (0.67) KDM1AMTORKDM4ERAB9ASMN1; SMN2
SCHEMBL684658 0.84 KDM1A (0.83) KDM1AMTORKDM4ERAB9ASMN1; SMN2
SCHEMBL684473 0.84 MTOR (0.77) KDM1AMTORKDM4ERAB9ASMN1; SMN2
SCHEMBL684770 0.84 NPC1 (0.69) KDM1AMTORKDM4ERAB9ASMN1; SMN2
SCHEMBL684771 0.84 KDM1A (0.70) KDM1AMTORKDM4ERAB9ASMN1; SMN2
SCHEMBL12387768 0.82 KDM1A (0.74) KDM1AMTORKDM4ERAB9ASMN1; SMN2
SCHEMBL685147 0.82 KDM1A (0.62) KDM1AMTORKDM4ERAB9ASMN1; SMN2

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-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 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-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, SOD3 KDM1A 484/4885MTOR 2134/4885KDM4E 1473/4885

“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.