SCHEMBL1416484

SCHEMBL1416484

CC/C=C/CCOC(N)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.46
CHRM2 P08172 2/20 0.43
CHRM4 P08173 2/20 0.43
CHRM5 P08912 2/20 0.43
CHRM1 P11229 2/20 0.43
CHRM3 P20309 2/20 0.43
TSHR P16473 2/20 0.43
CHRNB2 P17787 2/20 0.43
CHRNA4 P43681 2/20 0.43
LMNA P02545 2/20 0.43
CYP2C19 P33261 2/20 0.43
HTR1A P08908 1/20 0.43
CHRNA7 P36544 1/20 0.43
ADORA3 P0DMS8 2/20 0.42
NR1I2 O75469 2/20 0.42
PTGS2 P35354 2/20 0.42
PGR P06401 1/20 0.42
PDE4D Q08499 1/20 0.42
ALDH1A1 P00352 6/20 0.41
CYP19A1 P11511 4/20 0.41

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
SCHEMBL1416487 1.00 ALOX15 (0.46) ALOX15CHRM2CHRM4CHRM5CHRM1
SCHEMBL1416753 1.00 ALOX15 (0.46) ALOX15CHRM2CHRM4CHRM5CHRM1
SCHEMBL28080557 0.89 LMNA (0.46) ALOX15CHRM2CHRM4CHRM5CHRM1
SCHEMBL16244148 0.88 ADORA3 (0.51) ALOX15CHRM2CHRM4CHRM5CHRM1
SCHEMBL16244348 0.87 ALOX15 (0.46) ALOX15CHRM2CHRM4CHRM5CHRM1
SCHEMBL1416629 0.86 LPAR2 (0.51) ALOX15TSHRLMNACYP2C19ADORA3
SCHEMBL1416626 0.86 LPAR2 (0.51) ALOX15TSHRLMNACYP2C19ADORA3
SCHEMBL1416796 0.84 LPAR2 (0.54) ALOX15TSHRLMNACYP2C19ADORA3
SCHEMBL1416611 0.84 LPAR2 (0.54) ALOX15TSHRLMNACYP2C19ADORA3
SCHEMBL28335255 0.83 NR1I2 (0.45) ALOX15CHRM2CHRM4CHRM5CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110446778-A 2,3,6- cyclonol is as aromatic and/or flavoring agent SYMRISE AG 2019-11-12 CN disclosed
EP-2755949-B1 FUNGICIDAL 4-SUBSTITUTED-3-{PHENYL[(HETEROCYCLYLMETHOXY)IMINO]METHYL}-1,2,4-OXADIZOL-5(4H)-ONE DERIVATIVES BAYER IP GMBH (DE) 2015-10-21 EP disclosed
US-9090600-B2 Fungicidal 4-substituted-3-{phenyl[(heterocyclylmethoxy)imino]methyl}-1,2,4-oxadizol-5(4H)-one derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-07-28 US disclosed
US-20140349848-A1 FUNGICIDAL 4-SUBSTITUTED-3--1,2,4-OXADIZOL-5(4H)-ONE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-11-27 US disclosed
EP-1879856-B1 ALKYL-, ALKENYL- AND ALKYNYL CARBAMATE DERIVATIVES, THE PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2011-03-16 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 (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-20140349848-A1 FUNGICIDAL 4-SUBSTITUTED-3--1,2,4-OXADIZOL-5(4H)-ONE DERIVATIVES CYP4X1, CYP4B1, CYP4Z1 ALOX15 2823/4885CHRM2 605/4885CHRM4 175/4885

“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.