SCHEMBL3327320

SCHEMBL3327320

CC(C)(C)OC(=O)Nc1cc(Cl)cc(CCl)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.40
PTGER1 P34995 2/20 0.39
ATR Q13535 1/20 0.38
STK17B O94768 1/20 0.38
STK17A Q9UEE5 1/20 0.38
CCR2 P41597 2/20 0.37
CYP2C9 P11712 1/20 0.37
MAPKAPK2 P49137 2/20 0.37
GSK3B P49841 1/20 0.37
DYRK1A Q13627 1/20 0.37
LCK P06239 3/20 0.36
BRD4 O60885 1/20 0.36
GAA P10253 1/20 0.35
CYP17A1 P05093 1/20 0.35
KLKB1 P03952 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
ACACB O00763 1/20 0.35

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
SCHEMBL3329005 0.89 S1PR2 (0.41) SCN9APTGER1ATRSTK17BSTK17A
SCHEMBL31248850 0.87 ATR (0.45) SCN9APTGER1ATRSTK17BSTK17A
SCHEMBL16147173 0.87 ATR (0.45) SCN9APTGER1ATRSTK17BSTK17A
SCHEMBL31235341 0.83 LCK (0.39) SCN9APTGER1ATRCYP2C9MAPKAPK2
SCHEMBL21590399 0.81 CYP1A2 (0.41) SCN9APTGER1ATRCYP2C9GSK3B
SCHEMBL8307596 0.79 CCR2 (0.44) SCN9AATRCCR2GSK3BDYRK1A
SCHEMBL29955764 0.78 ATR (0.40) SCN9APTGER1ATRCYP2C9MAPKAPK2
SCHEMBL4443611 0.77 LCK (0.41) SCN9APTGER1ATRSTK17BSTK17A
SCHEMBL28662508 0.76 S1PR2 (0.47) SCN9APTGER1ATR
SCHEMBL22028916 0.76 ATR (0.44) SCN9APTGER1ATRSTK17BSTK17A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2177519-B1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT NIPPON SODA CO (JP) 2015-05-27 EP disclosed
US-9029552-B2 Tetrazoyloxime derivative and plant disease control agent NIPPON SODA CO., LTD. (JP) 2015-05-12 US disclosed
US-20140005385-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2014-01-02 US disclosed
EP-2669282-A1 Tetrazoyloxime derivative and plant disease control agent NIPPON SODA CO., LTD. (JP) 2013-12-04 EP disclosed
US-20100137594-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2010-06-03 US disclosed
EP-2177519-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT Nippon Soda Co., Ltd. (JP) 2010-04-21 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-20140005385-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT PAOX, BROX, TTI2 SCN9A 2254/4885PTGER1 4381/4885ATR 1646/4885
US-20100137594-A1 TETRAZOYLOXIME DERIVATIVE AND PLANT DISEASE CONTROL AGENT PAOX, H1-10, HAX1 SCN9A 934/4885PTGER1 977/4885ATR 2828/4885

“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.