SCHEMBL4391246

SCHEMBL4391246

Fc1cccc(F)c1-c1ncc(-c2ccc(-c3ccc(OC(F)(F)F)cc3)cc2)cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 1/20 0.45
SCN5A Q14524 7/20 0.42
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
NPY5R Q15761 1/20 0.39
ABL1 P00519 3/20 0.39
SCN10A Q9Y5Y9 2/20 0.39
KCNH2 Q12809 2/20 0.39
SCN1A P35498 1/20 0.39
SCN9A Q15858 1/20 0.39
SCN2A Q99250 1/20 0.39
SCN8A Q9UQD0 1/20 0.39
SYK P43405 1/20 0.39
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38
AURKA O14965 1/20 0.38
TPX2 Q9ULW0 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL6266948 0.85 ALOX5AP (0.39) TYK2SCN5ANPY5RABL1SCN10A
SCHEMBL6762808 0.82 ALOX5AP (0.39) TYK2SCN5ACA12CA9NPY5R
SCHEMBL20654333 0.77 NPC1 (0.59) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL6270519 0.76 SCN5A (0.39) TYK2SCN5ASCN1ASCN2AALOX5AP
SCHEMBL4389561 0.76 NPC1 (0.58) ALOX5APFEN1KDM4ENPC1ALDH1A1
SCHEMBL7685872 0.75 ALDH1A1 (0.48) SCN2AALDH1A1GAA
SCHEMBL3243263 0.74 TEK (0.46) SCN5ACA12CA9NPY5RABL1
SCHEMBL1230049 0.74 SCN5A (0.48) SCN5ACA12CA9NPY5RSCN10A
SCHEMBL1227164 0.74 CHRM5 (0.52) SCN5ACA12CA9NPY5RABL1
SCHEMBL16215338 0.74 GABBR2 (0.49) SCN5ACA12CA9SCN10AKCNH2

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-1175407-B1 PESTICIDAL PYRIMIDINE-DERIVATIVES NOVARTIS AG (CH) 2009-12-09 EP disclosed
US-6686469-B2 TREATMENT FOR PLANT PROPAGATION MATERIAL FOR PARASITICIDES NOVARTIS ANIMAL HEALTH US, INC. 2004-02-03 US disclosed
US-20030004347-A1 Pesticidal pyrimidine-derivatives NOVARTIS ANIMAL HEALTH US, INC. 2003-01-02 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-20030004347-A1 Pesticidal pyrimidine-derivatives CTRC, HCN1, DDT TYK2 2985/4885SCN5A 1433/4885CA12 3227/4885

“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.