SCHEMBL45298

SCHEMBL45298

COC(=O)c1cc(C(O)Cn2nnnc2C(F)(F)F)nn1-c1ncccc1Cl

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.33
MALT1 Q9UDY8 5/20 0.32
TRPA1 O75762 2/20 0.32
TRPV1 Q8NER1 1/20 0.32
NOTUM Q6P988 1/20 0.31
P2RX7 Q99572 1/20 0.31
GCK P35557 2/20 0.31
RBP4 P02753 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
SCHEMBL341159 0.90 ALDH1A1 (0.33) TRPA1TRPV1
SCHEMBL15862865 0.85 DHODH (0.36) DHODHMALT1TRPA1TRPV1NOTUM
SCHEMBL44965 0.85 TRPA1 (0.34) TRPA1TRPV1
SCHEMBL44964 0.84 DHODH (0.34) DHODHMALT1TRPA1TRPV1NOTUM
SCHEMBL45070 0.78 MALT1 (0.35) DHODHMALT1TRPA1TRPV1NOTUM
SCHEMBL339427 0.78 MALT1 (0.35) DHODHMALT1TRPA1TRPV1NOTUM
SCHEMBL27917395 0.77 MALT1 (0.37) DHODHMALT1RBP4
SCHEMBL366413 0.75
SCHEMBL23142280 0.74 MARS1 (0.35) DHODHTRPA1TRPV1P2RX7
SCHEMBL29454971 0.74 P2RX7 (0.34) DHODHMALT1TRPA1TRPV1P2RX7

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 6 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
EP-2582688-A1 ANTHRANILIC ACID DIAMIDE DERIVATIVES Bayer Intellectual Property GmbH (DE) 2013-04-24 EP disclosed
CN-103068813-A Anthranilic acid diamide derivatives BAYER CROPSCIENCE AG 2013-04-24 CN disclosed
US-20120015980-A1 ANTHRANILIC DIAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2012-01-19 US disclosed
WO-2011157654-A1 ANTHRANILIC ACID DIAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2011-12-22 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-20120015980-A1 ANTHRANILIC DIAMIDE DERIVATIVES DDT, QDPR, ANTXR2 DHODH 197/4885MALT1 4605/4885TRPA1 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.