SCHEMBL4685242

SCHEMBL4685242

COc1ccc(C(=NO)c2nnnn2C)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ERCC5 P28715 1/20 0.38
FEN1 P39748 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
MGLL Q99685 1/20 0.37
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
HSD11B1 P28845 1/20 0.36

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
SCHEMBL22163777 0.85 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2KDM4EPOLBMGLL
SCHEMBL4684160 0.83 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2TDP1KDM4EPOLB
SCHEMBL4680198 0.82 LMNA (0.40) ALDH1A1SMN1; SMN2KDM4ERAB9A
SCHEMBL4684225 0.82 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2POLBRAB9AHSD11B1
SCHEMBL968344 0.81 HPGD (0.41) ALDH1A1SMN1; SMN2TDP1KDM4EPOLB
SCHEMBL968342 0.81 HPGD (0.41) ALDH1A1SMN1; SMN2TDP1KDM4EPOLB
SCHEMBL3328603 0.81 HPGD (0.41) ALDH1A1SMN1; SMN2TDP1KDM4EPOLB
SCHEMBL22167312 0.81 HPGD (0.35) ALDH1A1POLB
SCHEMBL10425548 0.79 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2TDP1KDM4EERCC5
SCHEMBL4683697 0.79 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2KDM4EERCC5FEN1

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
EP-1426371-B1 TETRAZOYL OXIME DERIVATIVES AND AGROCHEMICALS CONTAINING THE SAME AS THE ACTIVE INGREDIENT NIPPON SODA CO (JP) 2008-12-03 EP disclosed
US-20070105926-A1 Tetrazoyloxime derivative and agricultural chemical containing the same as active ingredient NIPPON SODA CO., LTD (JP) 2007-05-10 US disclosed
US-20070105926-A1 Tetrazoyloxime derivative and agricultural chemical containing the same as active ingredient NIPPON SODA CO., LTD (JP) 2007-05-10 US disclosed
US-20070105926-A1 Tetrazoyloxime derivative and agricultural chemical containing the same as active ingredient NIPPON SODA CO., LTD (JP) 2007-05-10 US disclosed
US-7183299-B2 Tetrazoyl oxime derivative and agricultural chemical containing the same as active ingredient NIPPON SODA CO., LTD. (JP) 2007-02-27 US disclosed
US-7183299-B2 Tetrazoyl oxime derivative and agricultural chemical containing the same as active ingredient NIPPON SODA CO., LTD. (JP) 2007-02-27 US disclosed
US-7183299-B2 Tetrazoyl oxime derivative and agricultural chemical containing the same as active ingredient NIPPON SODA CO., LTD. (JP) 2007-02-27 US disclosed
US-20050070439-A1 Tetrazoyl oxime derivative and agricultural chemical containing the same as active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-03-31 US disclosed
EP-1426371-A1 TETRAZOYL OXIME DERIVATIVE AND AGRICULTURAL CHEMICAL CONTAINING THE SAME AS ACTIVE INGREDIENT DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-06-09 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 (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-20070105926-A1 Tetrazoyloxime derivative and agricultural chemical containing the same as active ingredient PAOX, TH, CYP2E1 ALDH1A1 2307/4885SMN1; SMN2 2940/4885TDP1 2113/4885
US-20050070439-A1 Tetrazoyl oxime derivative and agricultural chemical containing the same as active ingredient TH, CYP2E1, PAOX ALDH1A1 1724/4885SMN1; SMN2 2408/4885TDP1 1750/4885

“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.