SCHEMBL6742896

SCHEMBL6742896

Nc1ccc(C(=O)Nc2c(Cl)cc(C(F)(C(F)(F)F)C(F)(F)C(F)(F)F)cc2Cl)c(F)c1N

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SORT1 Q99523 1/20 0.35
PDE4B Q07343 5/20 0.34
FADS1 O60427 2/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
P2RX1 P51575 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
PTGS1 P23219 1/20 0.32
RORC P51449 1/20 0.32
P2RX4 Q99571 1/20 0.32
P2RX7 Q99572 1/20 0.32
TMPRSS4 Q9NRS4 1/20 0.32
KCNJ11 Q14654 1/20 0.31
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
TYK2 P29597 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
SCHEMBL3704403 0.86 AR (0.36) SORT1PDE4BTRPV1
SCHEMBL13456027 0.81 P2RX1 (0.35) SORT1POLBGAAP2RX1PTGS1
SCHEMBL3697985 0.80 AR (0.38) SORT1PDE4BTRPV1TMPRSS4
SCHEMBL298893 0.80 AR (0.33) SORT1GAA
SCHEMBL31375432 0.79 TRPV1 (0.54) KDM4ETRPV1RORC
SCHEMBL299858 0.79 TRPV1 (0.54) KDM4ETRPV1RORC
SCHEMBL13835625 0.77 P2RX1 (0.45) POLBGAAP2RX1RORC
SCHEMBL13836038 0.76 KDM4E (0.40) FADS1KDM4EPOLBGAAP2RX1
SCHEMBL13508340 0.76 SMN1; SMN2 (0.34) KDM4EP2RX1TRPV1PTGS1TMPRSS4
SCHEMBL17482146 0.75 FADS1 (0.44) FADS1KDM4EPOLBGAAP2RX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120122975-A1 4-CYANO-3-BENZOYLAMINO-N-PHENYL-BENZAMIDES FOR USE IN PEST CONTROL SYNGENTA CROP PROTECTION LLC (US) 2012-05-17 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-20120122975-A1 4-CYANO-3-BENZOYLAMINO-N-PHENYL-BENZAMIDES FOR USE IN PEST CONTROL NISCH, AADAC, ACHE SORT1 4874/4885PDE4B 697/4885FADS1 1215/4885

“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.