SCHEMBL13824907

SCHEMBL13824907

O=C1OC(c2ccccc2)C(c2ccccc2)=C1c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
PTGS2 P35354 2/20 0.45
CA2 P00918 1/20 0.43
KMT2A Q03164 5/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RAB9A P51151 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KDM4E B2RXH2 4/20 0.40
LMNA P02545 3/20 0.40
MAPK1 P28482 1/20 0.40
POLB P06746 2/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 1/20 0.40
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
ADK P55263 1/20 0.37
ALDH2 P05091 1/20 0.35
PTGS1 P23219 1/20 0.35
PDE4B Q07343 1/20 0.34

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
SCHEMBL13825188 0.79 RAB9A (0.47) ALDH1A1CA2KMT2ASMN1; SMN2RAB9A
SCHEMBL11894735 0.79 ALDH1A1 (0.46) ALDH1A1PTGS2CA2KMT2ASMN1; SMN2
SCHEMBL11895442 0.79 ALDH1A1 (0.46) ALDH1A1PTGS2CA2KMT2ASMN1; SMN2
SCHEMBL13725656 0.77 ALDH1A1 (0.45) ALDH1A1PTGS2CA2KMT2ASMN1; SMN2
SCHEMBL13726049 0.75 ALDH1A1 (0.42) ALDH1A1CA2KMT2ASMN1; SMN2RAB9A
SCHEMBL6348979 0.74 PTGS2 (0.71) PTGS2KMT2AKDM4ELMNAPOLB
SCHEMBL27388588 0.74 PTGS2 (0.47) ALDH1A1PTGS2CA2KMT2ASMN1; SMN2
SCHEMBL13725914 0.74 LMNA (0.44) ALDH1A1CA2KMT2ASMN1; SMN2RAB9A
SCHEMBL13825087 0.73 ALDH1A1 (0.40) ALDH1A1PTGS2CA2KMT2ASMN1; SMN2
SCHEMBL11894848 0.73 ALDH1A1 (0.40) ALDH1A1CA2KMT2ASMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10113052-B2 5H-furan-2-one derivatives stabilization of organic material BASF SE (DE) 2018-10-30 US disclosed
US-20160362535-A1 5H-FURAN-2-ONE DERIVATIVES STABILIZATION OF ORGANIC MATERIAL BASF SCHWEIZ AG (CH) 2016-12-15 US disclosed
US-20160362535-A1 5H-FURAN-2-ONE DERIVATIVES STABILIZATION OF ORGANIC MATERIAL BASF SCHWEIZ AG (CH) 2016-12-15 US disclosed
US-20160362535-A1 5H-FURAN-2-ONE DERIVATIVES STABILIZATION OF ORGANIC MATERIAL BASF SCHWEIZ AG (CH) 2016-12-15 US disclosed
US-9458380-B2 5H-furan-2-one derivatives for stabilization of organic material BASF SE (DE) 2016-10-04 US disclosed
US-9458380-B2 5H-furan-2-one derivatives for stabilization of organic material BASF SE (DE) 2016-10-04 US disclosed
US-9458380-B2 5H-furan-2-one derivatives for stabilization of organic material BASF SE (DE) 2016-10-04 US disclosed
EP-2705082-B1 5H-FURAN-2-ONE DERIVATIVES FOR STABILIZATION OF ORGANIC MATERIAL BASF SE (DE) 2015-09-23 EP disclosed
EP-2705082-B1 5H-FURAN-2-ONE DERIVATIVES FOR STABILIZATION OF ORGANIC MATERIAL BASF SE (DE) 2015-09-23 EP disclosed
US-20140058021-A1 5H-Furan-2-one Derivatives for Stabilization of Organic Material BASF SE (DE) 2014-02-27 US disclosed
US-20140058021-A1 5H-Furan-2-one Derivatives for Stabilization of Organic Material BASF SE (DE) 2014-02-27 US disclosed
US-20140058021-A1 5H-Furan-2-one Derivatives for Stabilization of Organic Material BASF SE (DE) 2014-02-27 US disclosed
WO-2012150527-A1 5H-FURAN-2-ONE DERIVATIVES FOR STABILIZATION OF ORGANIC MATERIAL BASF SE (DE) 2012-11-08 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-10113052-B2 5H-furan-2-one derivatives stabilization of organic material C5, C9, CBR1 ALDH1A1 188/4885PTGS2 213/4885CA2 2492/4885
US-20160362535-A1 5H-FURAN-2-ONE DERIVATIVES STABILIZATION OF ORGANIC MATERIAL C5, C9, CBR1 ALDH1A1 188/4885PTGS2 213/4885CA2 2492/4885

“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.