SCHEMBL339535

SCHEMBL339535

O=C(O)c1cc(N2CCN(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2=O)nn1-c1ncccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 2/20 0.40
TRPV1 Q8NER1 4/20 0.40
TRPA1 O75762 2/20 0.40
CYP17A1 P05093 3/20 0.35
MAP3K14 Q99558 1/20 0.34
ALDH1A1 P00352 3/20 0.33
HTT P42858 2/20 0.33
HSD11B1 P28845 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GAA P10253 1/20 0.33
RORC P51449 2/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL45076 0.87 MALT1 (0.40) MALT1TRPV1TRPA1ALDH1A1HSD11B1
SCHEMBL45356 0.86 TRPA1 (0.42) MALT1TRPV1TRPA1CYP17A1MAP3K14
SCHEMBL10118301 0.80 MALT1 (0.39) MALT1TRPV1TRPA1ALDH1A1HTT
SCHEMBL10118306 0.79 MALT1 (0.37) MALT1TRPV1TRPA1ALDH1A1HTT
SCHEMBL10118302 0.78 MALT1 (0.37) MALT1TRPV1
SCHEMBL10118305 0.77 MALT1 (0.36) MALT1TRPV1
SCHEMBL10118308 0.77 MALT1 (0.36) MALT1TRPV1TRPA1
SCHEMBL535347 0.74 KLKB1 (0.49) MALT1TRPV1TRPA1ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL536232 0.73 KLKB1 (0.48) MALT1TRPV1TRPA1ALDH1A1KDM4E
SCHEMBL2131767 0.73 TRPV1 (0.35) MALT1TRPV1TRPA1KDM4ERORC

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-2582688-B1 ANTHRANILIC ACID DIAMIDE DERIVATIVES BAYER IP GMBH (DE) 2015-10-07 EP disclosed
US-8791139-B2 Anthranilic diamide derivatives BAYER CROPSCIENCE AG (DE) 2014-07-29 US disclosed
US-20120015980-A1 ANTHRANILIC DIAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2012-01-19 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-20120015980-A1 ANTHRANILIC DIAMIDE DERIVATIVES DDT, QDPR, ANTXR2 MALT1 4605/4885TRPV1 2761/4885TRPA1 1434/4885

“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.