SCHEMBL6701419

SCHEMBL6701419

C/C(=N\O)C(=O)c1ccc(F)cc1F

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.66
CES1 P23141 3/20 0.66
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
MAOB P27338 1/20 0.38
SNCA P37840 1/20 0.38
ACKR3 P25106 1/20 0.38

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
SCHEMBL6701425 1.00 CES2 (0.66) CES2CES1CYP11B1CYP11B2L3MBTL1
SCHEMBL7777968 0.81 CES2 (0.76) CES2CES1CYP11B1CYP11B2L3MBTL1
SCHEMBL8070666 0.80 CES2 (1.00) CES2CES1CYP11B1CYP11B2L3MBTL1
SCHEMBL15761173 0.80 CES2 (0.47) CES2CES1L3MBTL1MAPTPOLB
SCHEMBL6701469 0.79 CES2 (0.55) CES2CES1L3MBTL1MAPTSMN1; SMN2
SCHEMBL6701884 0.79 CES2 (0.55) CES2CES1L3MBTL1MAPTSMN1; SMN2
SCHEMBL6701474 0.79 CES2 (0.55) CES2CES1L3MBTL1MAPTSMN1; SMN2
SCHEMBL8666745 0.78 CES2 (0.63) CES2CES1MAPTSMN1; SMN2KDM4E
SCHEMBL8666744 0.78 CES2 (0.63) CES2CES1MAPTSMN1; SMN2KDM4E
SCHEMBL24445679 0.77 CES2 (0.52) CES2CES1MAPTPOLBSMN1; 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2927218-B1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-07-04 EP disclosed
US-9725423-B2 Tetrazolinone compound and applications thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-08 US disclosed
US-20150299146-A1 TETRAZOLINONE COMPOUND AND APPLICATIONS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-22 US disclosed
EP-2927218-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-07 EP disclosed
US-20040077895-A1 Process for the preparation of strobilurin intermediates WADITSCHATKA RUDOLF (CH) 2004-04-22 US disclosed
US-6664422-B1 Process for the preparation of strobilurin intermediates BAYER AKTIENGESELLSCHAFT (DE) 2003-12-16 US disclosed
EP-1137627-A1 PROCESS FOR THE PREPARATION OF STROBILURIN INTERMEDIATES Bayer Aktiengesellschaft (DE) 2001-10-04 EP disclosed
WO-2000034229-A1 PROCESS FOR THE PREPARATION OF STROBILURIN INTERMEDIATES BAYER AKTIENGESELLSCHAFT (DE) 2000-06-15 WO disclosed
US-5786374-A FUNGICIDES, MICROBIOCIDES NOVARTIS CORPORATION (US) 1998-07-28 US disclosed
EP-0789692-A1 BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM Novartis AG (CH) 1997-08-20 EP disclosed
WO-1996014305-A1 BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM NOVARTIS AG (CH) 1996-05-17 WO 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-20040077895-A1 Process for the preparation of strobilurin intermediates TET1, CYP1B1, STS CES2 1780/4885CES1 1221/4885CYP11B1 140/4885
US-20150299146-A1 TETRAZOLINONE COMPOUND AND APPLICATIONS THEREOF RTN3, CYCS, ATL3 CES2 2697/4885CES1 2294/4885CYP11B1 615/4885

“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.