SCHEMBL3695100

SCHEMBL3695100

FC(F)(F)C1(c2cc(Cl)cc(Cl)c2)CC(c2ccccc2)=NO1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.44
NLRP3 Q96P20 1/20 0.38
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
PKM P14618 1/20 0.34
POLB P06746 1/20 0.34
ORAI1 Q96D31 1/20 0.33
KDM4E B2RXH2 4/20 0.33
SSTR5 P35346 1/20 0.33
MBD2 Q9UBB5 1/20 0.33
MAPT P10636 2/20 0.32
TSHR P16473 1/20 0.32
NPC1 O15118 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL16274185 0.90 RECQL (0.43) RECQLPKMKDM4EMAPTNPC1
SCHEMBL1611209 0.88 HTT (0.41) RECQLPKMPOLBKDM4ESSTR5
SCHEMBL3648777 0.88 RECQL (0.34) RECQLCA1CA2PKMKDM4E
SCHEMBL28551536 0.87 RECQL (0.38) RECQLNLRP3CA1CA2CHRNB4
SCHEMBL588568 0.87 RECQL (0.36) RECQLCA1CA2PKMNPC1
SCHEMBL3123277 0.87 HTT (0.43) RECQLNLRP3PKMKDM4EMAPT
SCHEMBL28971266 0.87 RECQL (0.36) RECQLCA1CA2PKMKDM4E
SCHEMBL1611047 0.87 RECQL (0.36) RECQLPKM
SCHEMBL566200 0.86 RECQL (0.38) RECQLNLRP3CA1CA2POLB
SCHEMBL472744 0.86 CA1 (0.37) RECQLCA1CA2PKMPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181100-A2 INSECTICIDAL ARYL ISOXAZOLINE DERIVATIVES Bayer CropScience AG (DE) 2010-05-05 EP disclosed
US-20080262057-A1 Diarylisoxazolines DOW AGROSCIENCES LLC (US) 2008-10-23 US disclosed
WO-2008122375-A2 INSECTICIDAL ARYL ISOXAZOLINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2008-10-16 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 (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-20080262057-A1 Diarylisoxazolines DDT, PRDX1, ACHE RECQL 1200/4885NLRP3 3665/4885CA1 1439/4885

“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.