SCHEMBL22337449

SCHEMBL22337449

FC(F)(F)c1ccc(-c2cccc(C(F)(F)F)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.47
SCN9A Q15858 3/20 0.47
KIF11 P52732 3/20 0.47
IDH1 O75874 2/20 0.46
IDH2 P48735 1/20 0.46
TRPV3 Q8NET8 7/20 0.46
HSD11B1 P28845 1/20 0.43
TGFBR1 P36897 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA3 P34903 1/20 0.43

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
SCHEMBL3381636 0.84 MEN1 (0.60) NOTUMIDH1IDH2GABRA1GABRG2
SCHEMBL19072771 0.83 CTSS (0.47) NOTUMIDH1IDH2TRPV3TGFBR1
SCHEMBL322547 0.83 ALDH1A1 (0.64) NOTUMKIF11IDH1IDH2TGFBR1
SCHEMBL2842049 0.83 NOTUM (0.46) NOTUMSCN9AIDH1IDH2TGFBR1
SCHEMBL28345610 0.82 KIF11 (0.65) SCN9AKIF11TRPV3
SCHEMBL30395354 0.81 NOTUM (0.58) NOTUMIDH1IDH2GABRA1GABRG2
SCHEMBL15624402 0.81 NOTUM (0.58) NOTUMIDH1IDH2GABRA1GABRG2
SCHEMBL30755399 0.81 TRPV3 (0.47) SCN9AKIF11TRPV3
SCHEMBL8612884 0.81 SCN9A (0.47) SCN9AKIF11TRPV3
SCHEMBL1800349 0.79 ASIC3 (0.60) SCN9AKIF11TRPV3

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
US-11220482-B2 Aminopyridinemethanol compounds and their use UNIVERSITE AMIENS PICARDIE JULES VERNE (FR) 2022-01-11 US disclosed
EP-3704093-A1 NOVEL AMINOPYRIDINEMETHANOL COMPOUNDS AND THEIR USE Université Amiens Picardie Jules Verne (FR) 2020-09-09 EP disclosed
US-20200255379-A1 NOVEL AMINOPYRIDINEMETHANOL COMPOUNDS AND THEIR USE UNIV AMIENS PICARDIE JULES VERNE (FR) 2020-08-13 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 (2 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-11220482-B2 Aminopyridinemethanol compounds and their use QDPR, PNMT, CYP3A43 NOTUM 1521/4885SCN9A 1397/4885KIF11 3487/4885
US-20200255379-A1 NOVEL AMINOPYRIDINEMETHANOL COMPOUNDS AND THEIR USE QDPR, PNMT, CYP3A43 NOTUM 1973/4885SCN9A 1141/4885KIF11 3467/4885

“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.