SCHEMBL2897642

SCHEMBL2897642

FC(F)c1[c]cnn1-c1ccc(Cl)cc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.38
HSD11B1 P28845 2/20 0.32
PHGDH O43175 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
TP53 P04637 1/20 0.31
KDM4E B2RXH2 1/20 0.30
SCN9A Q15858 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
RAB9A P51151 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
SCHEMBL2901987 0.84 HCAR1 (0.35) HCAR1HSD11B1PHGDHL3MBTL1TP53
SCHEMBL28422834 0.83 L3MBTL1 (0.38) L3MBTL1GABRA1GABRG2GABRB3GABRA5
SCHEMBL2897672 0.81 ALDH1A1 (0.40) HCAR1HSD11B1L3MBTL1KDM4ECYP1A2
SCHEMBL2900510 0.81 HCAR1 (0.42) HCAR1HSD11B1PHGDHL3MBTL1TP53
SCHEMBL2902919 0.74 HCAR1 (0.36) HCAR1HSD11B1PHGDHGABRA1GABRG2
SCHEMBL28417638 0.73 PTGS2 (0.35) TP53KDM4ERAB9A
SCHEMBL2901542 0.71
SCHEMBL2902936 0.71 KCNN4 (0.35) TP53
SCHEMBL15016086 0.69 MARS1 (0.43) HCAR1HSD11B1L3MBTL1
SCHEMBL2902968 0.68

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 HCAR1 2640/4885HSD11B1 4143/4885PHGDH 1610/4885

“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.