SCHEMBL6704201

SCHEMBL6704201

CC(=NO)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.60
CES1 P23141 3/20 0.60
MAPT P10636 4/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
POLB P06746 2/20 0.51
TRPA1 O75762 1/20 0.48
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
LMNA P02545 3/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
NLRP1 Q9C000 1/20 0.43

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
SCHEMBL6704195 1.00 CES2 (0.60) CES2CES1MAPTSMN1; SMN2POLB
SCHEMBL10814548 1.00 CES2 (0.60) CES2CES1MAPTSMN1; SMN2POLB
SCHEMBL10131971 0.82 CES2 (0.58) CES2CES1MAPTSMN1; SMN2POLB
SCHEMBL10131977 0.82 CES2 (0.58) CES2CES1MAPTSMN1; SMN2POLB
SCHEMBL5670381 0.81 CES2 (0.62) CES2CES1MAPTSMN1; SMN2POLB
SCHEMBL11230378 0.81 MAPT (0.53) CES2CES1MAPTSMN1; SMN2POLB
SCHEMBL9242877 0.81 MAPT (0.53) CES2CES1MAPTSMN1; SMN2POLB
SCHEMBL11371271 0.81 CES2 (0.62) CES2CES1MAPTSMN1; SMN2POLB
SCHEMBL5670379 0.81 CES2 (0.62) CES2CES1MAPTSMN1; SMN2POLB
SCHEMBL7871754 0.81 POLB (0.43) CES2CES1MAPTSMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-0984686-B1 METHOD FOR COMBATING HARMFUL FUNGI BASF AG (DE) 2002-02-20 EP disclosed
EP-1137627-A1 PROCESS FOR THE PREPARATION OF STROBILURIN INTERMEDIATES Bayer Aktiengesellschaft (DE) 2001-10-04 EP disclosed
US-6255352-B1 TREATING FUNGI, PLANTS, SOIL OR SEEDS WITH DOSAGE OF A BISOXIME DERIVATIVE BASF AKTIENGESELLSCHAFT (DE) 2001-07-03 US disclosed
WO-2000034229-A1 PROCESS FOR THE PREPARATION OF STROBILURIN INTERMEDIATES BAYER AKTIENGESELLSCHAFT (DE) 2000-06-15 WO disclosed
US-6063813-A FUNGICIDES AND INSECTICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-05-16 US disclosed
EP-0984686-A1 METHOD FOR COMBATING HARMFUL FUNGI BASF AKTIENGESELLSCHAFT (DE) 2000-03-15 EP disclosed
WO-1998053682-A1 METHOD FOR COMBATING HARMFUL FUNGI BASF AKTIENGESELLSCHAFT (DE) 1998-12-03 WO disclosed
EP-0077983-B1 TRIAZINE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-04-29 EP disclosed
US-4616014-A HYPOTENSIVE AGENTS, ANTICOAGULANTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-07 US disclosed
EP-0077983-A1 Triazine derivatives, processes for preparation thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-05-04 EP disclosed
US-4293552-A Novel 1-(mono-o-substituted benzoyl)-3-(substituted pyrazinyl) ureas ELI LILLY AND COMPANY (US) 1981-10-06 US disclosed
US-4160834-A INSECTICIDES ELI LILLY AND COMPANY (US) 1979-07-10 US disclosed
US-4083977-A Novel insecticidal 1-(substituted benzoyl)-3-(substituted pyrazinyl)ureas ELI LILLY AND COMPANY (US) 1978-04-11 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-20040077895-A1 Process for the preparation of strobilurin intermediates TET1, CYP1B1, STS CES2 1780/4885CES1 1221/4885MAPT 4731/4885

“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.