SCHEMBL4167660

SCHEMBL4167660

N#Cc1ccc(C=CCc2[c]c(C(F)(F)F)ccn2)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P4HB P07237 1/20 0.36
KIF11 P52732 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
GLA P06280 1/20 0.33
POLB P06746 1/20 0.33
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32
FBP1 P09467 1/20 0.32
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30

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
SCHEMBL4174412 0.84 GRM4 (0.35) ALDH1A1MAPTKDM4EGLA
SCHEMBL4168484 0.84 CHRNB2 (0.39) GRIK1GRIK2FBP1PPARGPPARA
SCHEMBL4168497 0.83 DCTPP1 (0.35) KDM4ENPC1GLA
SCHEMBL4177697 0.83 PDE4B (0.30)
SCHEMBL4168519 0.81 RELA (0.41) ALDH1A1MAPTKDM4ENPC1POLB
SCHEMBL4177913 0.80 GRIK1 (0.37) ALDH1A1MAPTKDM4ENPC1GRIK1
SCHEMBL4174113 0.79 NFE2L2 (0.36)
SCHEMBL4167639 0.78 CHRNB2 (0.32)
SCHEMBL4178066 0.77 AHR (0.40)
SCHEMBL4170967 0.77 RELA (0.38) ALDH1A1MAPTNPC1GLAGRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140179921-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2014-06-26 US disclosed
US-20130197029-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2013-08-01 US disclosed
US-8338443-B2 Chemical compounds SYNGENTA CROP PROTECTION LLC (US) 2012-12-25 US disclosed
US-20090118295-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC (US) 2009-05-07 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 (3 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-20130197029-A1 CHEMICAL COMPOUNDS MRM1, H1-0, RO60 P4HB 4611/4885KIF11 3918/4885ALDH1A1 857/4885
US-20140179921-A1 CHEMICAL COMPOUNDS H1-0, REL, ZYX P4HB 4023/4885KIF11 3017/4885ALDH1A1 1686/4885
US-20090118295-A1 CHEMICAL COMPOUNDS MRM1, MNS1, CHRM1 P4HB 4529/4885KIF11 3979/4885ALDH1A1 630/4885

“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.