SCHEMBL22337444

SCHEMBL22337444

FCCCCCCNCCc1cc(-c2ccc(C(F)(F)F)cc2)nc(C(F)(F)F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PAX8 Q06710 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ ACP1 P24666 1/20 0.37
▸ ADORA3 P0DMS8 1/20 0.37
▸ TP53 P04637 5/20 0.36
▸ CTSS P25774 1/20 0.36
▸ CTSK P43235 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ PTGS2 P35354 2/20 0.35
▸ ADORA2A P29274 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ HDAC3 O15379 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34

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
SCHEMBL22337275 0.89 PTGS2 (0.43) MAPTMEN1GAAMAPK1KMT2A
SCHEMBL22337460 0.89 PTGS2 (0.43) MAPTMEN1GAAMAPK1KMT2A
SCHEMBL22337439 0.89 SDHB (0.43) MAPTTP53SMN1; SMN2PTGS2PTGS1
SCHEMBL22337278 0.89 MAOB (0.42) MAPTMEN1GAAMAPK1KMT2A
SCHEMBL22337594 0.80 PTGS2 (0.43) MAPTTP53PTGS2PTGS1
SCHEMBL22337642 0.80 PTGS2 (0.43) MAPTTP53PTGS2PTGS1
SCHEMBL22321553 0.79 MEN1 (0.46) MAPTMEN1GAAMAPK1KMT2A
SCHEMBL22321588 0.79 MEN1 (0.46) MAPTMEN1GAAMAPK1KMT2A
SCHEMBL22337593 0.79 PTGS2 (0.44) MAPTTP53PTGS2PTGS1
SCHEMBL22337287 0.77 MAPT (0.44) MAPTMEN1GAAMAPK1KMT2A

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-11220482-B2 Aminopyridinemethanol compounds and their use UNIVERSITE AMIENS PICARDIE JULES VERNE (FR) 2022-01-11 — — US 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 MAPT 300/4885MEN1 2962/4885GAA 2188/4885
US-20200255379-A1 NOVEL AMINOPYRIDINEMETHANOL COMPOUNDS AND THEIR USE QDPR, PNMT, CYP3A43 MAPT 363/4885MEN1 3616/4885GAA 2823/4885

“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.

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