SCHEMBL22023766

SCHEMBL22023766

CCCCC(C)(CC)c1ccc(F)cn1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ BRS3 P32247 1/20 0.32
▸ HTR7 P34969 1/20 0.30
▸ AXL P30530 1/20 0.30
▸ TYRO3 Q06418 1/20 0.30
▸ MERTK Q12866 1/20 0.30
▸ FFAR1 O14842 1/20 0.30
▸ FFAR4 Q5NUL3 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
SCHEMBL20047718 0.95 ALDH1A1 (0.31) TLR8ALDH1A1BRS3
SCHEMBL22624130 0.90 TLR8 (0.33) TLR8HTR7AXLTYRO3MERTK
SCHEMBL19464697 0.90 ALDH1A1 (0.33) ALDH1A1BRS3
SCHEMBL19177001 0.87 PSMD14 (0.33) TLR8HTR7AXLTYRO3MERTK
SCHEMBL18505949 0.86 ALDH1A1 (0.37) ALDH1A1BRS3
SCHEMBL23502493 0.84 PSMD14 (0.32) AXLTYRO3MERTK
SCHEMBL20609558 0.81 RAB9A (0.39) —
SCHEMBL20927014 0.78 CASP3 (0.37) ALDH1A1
SCHEMBL18474327 0.78 TLR8 (0.34) TLR8
SCHEMBL22601465 0.77 CNR2 (0.38) —

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-11198693-B2 Functionalized heterocycles as antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2021-12-14 — — US disclosed
US-20200165249-A1 FUNCTIONALIZED HETEROCYCLES AS ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2020-05-28 — — 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-11198693-B2 Functionalized heterocycles as antiviral agents HCCS, HAVCR2, HDGF TLR8 2663/4885ALDH1A1 2352/4885BRS3 3189/4885
US-20200165249-A1 FUNCTIONALIZED HETEROCYCLES AS ANTIVIRAL AGENTS HCCS, HAVCR2, HDGF TLR8 2663/4885ALDH1A1 2352/4885BRS3 3189/4885

“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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