SCHEMBL44847

SCHEMBL44847

COC(=O)c1cc(C(=O)Nc2ccc(C(F)(F)F)cc2)nn1-c1ncccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 12/20 0.53
NPY5R Q15761 1/20 0.45
TRPA1 O75762 2/20 0.43
KCNH2 Q12809 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
PTGS1 P23219 1/20 0.43
EPHX2 P34913 1/20 0.43
PTGS2 P35354 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL44846 0.83 TRPV1 (0.50) TRPV1NPY5RTRPA1PTGS1EPHX2
SCHEMBL384694 0.82 ALDH1A1 (0.45) MEN1KMT2A
SCHEMBL45318 0.80 KMT2A (0.41) MEN1KMT2A
SCHEMBL10118261 0.79 TRPV1 (0.45) TRPV1NPY5R
SCHEMBL10118252 0.79 TRPV1 (0.43) TRPV1NPY5R
SCHEMBL44829 0.79 TRPV1 (0.43) TRPV1TRPA1KCNH2
SCHEMBL10118246 0.78 TRPV1 (0.44) TRPV1NPY5R
SCHEMBL10118247 0.78 TRPV1 (0.42) TRPV1NPY5R
SCHEMBL44880 0.77 OPRL1 (0.41) TRPV1TRPA1MEN1KMT2A
SCHEMBL23249321 0.75 DHODH (0.45)

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 5 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
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 TRPV1 2761/4885NPY5R 443/4885TRPA1 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.