SCHEMBL6720689

SCHEMBL6720689

CSc1cc(C(F)(C(C)(F)F)C(F)(F)F)cc(Cl)c1NC(=O)c1ccc(C#N)c([N+](=O)[O-])c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
LMNA P02545 4/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
POLB P06746 1/20 0.42
XBP1 P17861 1/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 2/20 0.39
HSP90AA1 P07900 1/20 0.39
HPGD P15428 1/20 0.39
VCAM1 P19320 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
BRAF P15056 1/20 0.36
GAA P10253 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL3702064 0.93 MAPT (0.43) MAPTLMNAKMT2AMEN1NPSR1
SCHEMBL13075108 0.87 MAPT (0.44) MAPTLMNAKMT2AMEN1NPSR1
SCHEMBL297406 0.86 MAPT (0.51) MAPTLMNAKMT2AMEN1NPSR1
SCHEMBL6720686 0.86 AR (0.36) LMNAKMT2AMEN1POLBALDH1A1
SCHEMBL3707169 0.84 MAPT (0.48) MAPTLMNAKMT2AMEN1NPSR1
SCHEMBL289013 0.82 MAPT (0.47) MAPTLMNAKMT2AMEN1NPSR1
SCHEMBL299618 0.80 MAPT (0.45) MAPTLMNAKMT2AMEN1NPSR1
SCHEMBL3210249 0.80 MAPT (0.44) MAPTLMNAKMT2AMEN1NPSR1
SCHEMBL3705856 0.79 KMT2A (0.36) LMNAKMT2AMEN1POLBALDH1A1
SCHEMBL3706541 0.77 MAPT (0.42) MAPTLMNAKMT2AMEN1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431514-B2 4-cyano-3-benzoylamino-N-phenyl-benzamides for use in pest control SYNGENTA CROP PROTECTION LLC (US) 2013-04-30 US disclosed
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 MAPT 3060/4885LMNA 172/4885KMT2A 901/4885

“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.