SCHEMBL684595

SCHEMBL684595

C/C(=N\NC(=O)c1cccc(C)c1)c1cc(C)ccc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.62
ALDH1A1 P00352 5/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
RAB9A P51151 3/20 0.62
GAA P10253 3/20 0.62
KDM4E B2RXH2 2/20 0.62
HTT P42858 2/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
PKM P14618 1/20 0.62
MCL1 Q07820 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
KDM1A O60341 8/20 0.61
MTOR P42345 2/20 0.54
NPC1 O15118 2/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 2/20 0.51

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
SCHEMBL685005 0.90 KDM1A (0.74) MAPTALDH1A1SMN1; SMN2RAB9AGAA
SCHEMBL684061 0.90 KDM1A (0.70) MAPTALDH1A1SMN1; SMN2RAB9AGAA
SCHEMBL684832 0.90 KDM1A (0.77) MAPTALDH1A1SMN1; SMN2RAB9AGAA
SCHEMBL684686 0.90 CYP1A2 (0.60) MAPTALDH1A1SMN1; SMN2RAB9AGAA
SCHEMBL683725 0.89 KDM1A (0.67) MAPTALDH1A1SMN1; SMN2RAB9AGAA
SCHEMBL683850 0.88 MAPT (0.58) MAPTALDH1A1SMN1; SMN2RAB9AGAA
SCHEMBL684598 0.87 KDM1A (0.61) MAPTALDH1A1SMN1; SMN2RAB9AGAA
SCHEMBL686344 0.87 KDM1A (0.56) MAPTALDH1A1SMN1; SMN2RAB9AGAA
SCHEMBL16767884 0.84 KDM1A (0.79) MAPTALDH1A1SMN1; SMN2RAB9AGAA
SCHEMBL685136 0.83 SMN1; SMN2 (0.62) MAPTALDH1A1SMN1; SMN2RAB9AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-06-14 US disclosed
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 (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-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, SOD3 MAPT 1491/4885ALDH1A1 127/4885SMN1; SMN2 4107/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 MAPT 921/4885ALDH1A1 115/4885SMN1; SMN2 3775/4885

“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.