SCHEMBL22337457

SCHEMBL22337457

CCCCNCCc1ccc(-c2ccc(C(F)(F)F)cc2)nc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 1/20 0.41
▸ CTSS P25774 1/20 0.39
▸ CTSK P43235 1/20 0.39
▸ TRPV3 Q8NET8 10/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ PTGS2 P35354 1/20 0.35
▸ ATP4A P20648 2/20 0.35
▸ ATP4B P51164 2/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ ADORA3 P0DMS8 1/20 0.35
▸ MPO P05164 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
SCHEMBL22337267 0.95 TLR8 (0.42) TLR8CTSSCTSKTRPV3MEN1
SCHEMBL22337685 0.88 TRPV3 (0.35) CTSSCTSKTRPV3
SCHEMBL22337443 0.87 TRPV3 (0.34) CTSSCTSKTRPV3
SCHEMBL22337741 0.79 CYP11B1 (0.34) TRPV3MEN1KMT2ASMN1; SMN2PTGS2
SCHEMBL22337652 0.78 MTOR (0.39) TRPV3
SCHEMBL22337520 0.78 TRPV3 (0.40) TLR8CTSSCTSKTRPV3MEN1
SCHEMBL22321622 0.77 KCNH2 (0.44) TLR8TRPV3MEN1LMNAHTT
SCHEMBL22321567 0.77 KCNH2 (0.44) TLR8TRPV3MEN1LMNAHTT
SCHEMBL22321569 0.77 KCNH2 (0.44) TLR8TRPV3MEN1LMNAHTT
SCHEMBL22337682 0.76 TRPV3 (0.43) TRPV3

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 TLR8 2297/4885CTSS 3161/4885CTSK 2863/4885
US-20200255379-A1 NOVEL AMINOPYRIDINEMETHANOL COMPOUNDS AND THEIR USE QDPR, PNMT, CYP3A43 TLR8 2730/4885CTSS 3433/4885CTSK 3294/4885

“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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