SCHEMBL2903085

SCHEMBL2903085

FC(F)(F)c1cccnc1-n1c[c]cn1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.51
HSD11B1 P28845 11/20 0.42
GAA P10253 2/20 0.39
TRPV1 Q8NER1 3/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
RBP4 P02753 1/20 0.38
CYP17A1 P05093 1/20 0.37

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
SCHEMBL2897568 0.88 EPHX2 (0.39) EPHX2HSD11B1GAATRPV1
SCHEMBL2897047 0.78 ALDH1A1 (0.44) EPHX2HSD11B1TRPV1MAPTHTT
SCHEMBL28324866 0.77 EPHX2 (0.50) EPHX2HSD11B1GAAMAPTTSHR
SCHEMBL2752024 0.76 HSD11B1 (0.33) EPHX2HSD11B1MAPT
SCHEMBL2752562 0.74 HSD11B1 (0.37) EPHX2HSD11B1MAPT
SCHEMBL2902441 0.74
SCHEMBL29454957 0.74 EPHX2 (0.54) EPHX2HSD11B1GAAMAPTTSHR
SCHEMBL7221097 0.73 POLB (0.35) MAPTNPC1RAB9ARBP4
SCHEMBL2897752 0.73 EPHX2 (0.47) EPHX2HSD11B1GAATRPV1MAPT
SCHEMBL2389091 0.73 EPHX2 (0.47) EPHX2HSD11B1GAATRPV1MAPT

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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
EP-2236505-A1 Acylated aminopyridines and pyridazines as insecticides Bayer CropScience AG (DE) 2010-10-06 EP 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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR EPHX2 2167/4885HSD11B1 4143/4885GAA 2373/4885

“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.