SCHEMBL922375

SCHEMBL922375

Fc1[c]cccc1OCc1ccoc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TXNRD1 Q16881 1/20 0.37
TXNRD3 Q86VQ6 1/20 0.37
TXNRD2 Q9NNW7 1/20 0.37
GABRA1 P14867 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
HPGD P15428 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PKM P14618 1/20 0.33
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
KMT2A Q03164 3/20 0.31
NPC1 O15118 2/20 0.31
MEN1 O00255 2/20 0.31
CETP P11597 1/20 0.31
HTR1A P08908 1/20 0.31

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
SCHEMBL3211927 0.79 MAPT (0.50) ALDH1A1PKMNPC1HTR1ASLC6A2
SCHEMBL920470 0.79 ALDH1A1 (0.50) HPGDALDH1A1PKMKMT2ANPC1
SCHEMBL919103 0.76 DHFR (0.45) ALDH1A1PKMKMT2ANPC1MEN1
SCHEMBL921988 0.75 MAPT (0.46) KMT2ANPC1MEN1HTR1ASLC6A2
SCHEMBL920040 0.75 KMT2A (0.44) ALDH1A1PKMKMT2ANPC1MEN1
SCHEMBL921724 0.75 SMN1; SMN2 (0.50) ALDH1A1PKMKMT2ANPC1MEN1
SCHEMBL921216 0.74 IDO1 (0.51) ALDH1A1KMT2AMEN1MAPTL3MBTL1
SCHEMBL919722 0.74 GAA (0.44) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL921811 0.73 PARP15 (0.36) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL919788 0.73 NPC1 (0.51) NPC1HTR1ARAB9AADRA1DADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110201649-A1 AGRICULTURAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
EP-2345328-A1 COMPOSITION FOR AGRICULTURAL USE Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 TXNRD1 332/4885TXNRD3 178/4885TXNRD2 221/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 TXNRD1 2027/4885TXNRD3 2964/4885TXNRD2 3100/4885

“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.