SCHEMBL10136581

SCHEMBL10136581

Cc1cc(Cl)cc(C(=O)NC(C)C2CC2)c1NC(=O)c1cc(CNS(=O)(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)nn1-c1ncccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR8 P51685 1/20 0.35
ALDH1A1 P00352 2/20 0.33
GPBAR1 Q8TDU6 2/20 0.33
ACLY P53396 2/20 0.33
MALT1 Q9UDY8 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
IDO1 P14902 1/20 0.32
MDM2 Q00987 1/20 0.32
KCNK3 O14649 1/20 0.32
PDK1 Q15118 1/20 0.31
PDK2 Q15119 1/20 0.31
PDK3 Q15120 1/20 0.31
PDK4 Q16654 1/20 0.31
TP53 P04637 1/20 0.31
OPRL1 P41146 1/20 0.31
SCN9A Q15858 1/20 0.31
LMNA P02545 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
SCHEMBL10118322 0.92 ALDH1A1 (0.35) ALDH1A1GPBAR1ACLYPDK1PDK2
SCHEMBL10118329 0.89 ALDH1A1 (0.37) ALDH1A1GPBAR1ACLYMALT1PDK1
SCHEMBL10136626 0.87 POLB (0.37) ALDH1A1PDK1PDK2PDK3PDK4
SCHEMBL10136612 0.87 ALDH1A1 (0.35) ALDH1A1TRPV1PDK1PDK2PDK3
SCHEMBL10136315 0.86 MDM2 (0.32) CCR8MALT1TRPV1IDO1MDM2
SCHEMBL2293988 0.85 KLKB1 (0.39) MALT1TRPV1IDO1
SCHEMBL10136641 0.85 ALDH1A1 (0.34) ALDH1A1MALT1
SCHEMBL12117034 0.84 WDR5 (0.37) MALT1IDO1
SCHEMBL10136627 0.84 ALDH1A1 (0.39) ALDH1A1MALT1LMNA
SCHEMBL10136248 0.84 LMNA (0.41) ALDH1A1PDK1PDK2PDK3PDK4

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 CCR8 4742/4885ALDH1A1 732/4885GPBAR1 1758/4885

“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.