SCHEMBL3210164

SCHEMBL3210164

Cc1cc(C(F)(C(F)(F)F)C(F)(F)C(F)(F)F)cc(Br)c1NC(=O)c1ccc(C#N)c(N)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.34
LCK P06239 6/20 0.34
S1PR3 Q99500 3/20 0.34
KDR P35968 2/20 0.32
TEK Q02763 2/20 0.32
GRM5 P41594 2/20 0.32
MTOR P42345 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
BRAF P15056 1/20 0.32
KCNQ3 O43525 1/20 0.31
KCNQ2 O43526 1/20 0.31
KCNE1 P15382 1/20 0.31
KCNQ1 P51787 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
SCHEMBL3224938 0.95 HDAC1 (0.36) HDAC1LCKS1PR3KDRTEK
SCHEMBL3777934 0.94 KCNQ3 (0.33) HDAC1S1PR3MAPTNPSR1KCNQ3
SCHEMBL3701195 0.93 LCK (0.39) HDAC1LCKS1PR3KDRTEK
SCHEMBL3213487 0.90 KDM4E (0.34) HDAC1GRM5KCNQ3KCNQ2KCNE1
SCHEMBL3695537 0.89 KCNQ3 (0.35) S1PR3MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL3219952 0.89 KCNQ3 (0.35) HDAC1S1PR3MAPTNPSR1KCNQ3
SCHEMBL3011716 0.88 LCK (0.41) HDAC1LCKS1PR3KDRTEK
SCHEMBL3217239 0.87 KDM4E (0.35) HDAC1LCKS1PR3KDRTEK
SCHEMBL3715668 0.87 PKM (0.41) HDAC1S1PR3MAPTHTT
SCHEMBL3221010 0.85 MAPT (0.39) NPC1RAB9AMEN1MAPTHTT

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-2120556-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-03-09 EP disclosed
US-8389766-B2 Insecticidal compounds SYNGENTA CROP PROTECTION LLC (US) 2013-03-05 US disclosed
US-20100056639-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-03-04 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-20100056639-A1 INSECTICIDAL COMPOUNDS ACHE, CHRM1, NIT2 HDAC1 234/4885LCK 4621/4885S1PR3 867/4885

“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.