SCHEMBL23844281

SCHEMBL23844281

CN[C@@H](C)C(=O)OCC1(C)CC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 2/20 0.33
▸ MME P08473 1/20 0.31
▸ CHRNB2 P17787 1/20 0.30
▸ CHRNA4 P43681 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
SCHEMBL23844148 0.83 ACACB (0.35) ACACB
SCHEMBL12413767 0.79 NPSR1 (0.35) ACACB
SCHEMBL26277348 0.76 GRIN2D (0.33) ACACBCHRNB2CHRNA4
Hydrochloric Acid SCHEMBL23827948 0.74 GRIN2D (0.33) ACACBCHRNB2CHRNA4
Hydrochloric Acid SCHEMBL23827944 0.74 GRIN2D (0.33) ACACBCHRNB2CHRNA4
SCHEMBL12705012 0.74 — —
SCHEMBL28632681 0.74 CHRNB2 (0.41) ACACBCHRNB2CHRNA4
SCHEMBL17032828 0.73 ACACB (0.38) ACACBRAB9A
SCHEMBL15490005 0.72 NPSR1 (0.33) —
SCHEMBL15487498 0.72 ALDH1A1 (0.39) ACACB

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-12030903-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2024-07-09 — — US disclosed
US-20210292348-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2021-09-23 — — 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-12030903-B2 Antiviral compounds EIF2AK2, MAVS, DUT ACACB 3353/4885MME 491/4885CHRNB2 4873/4885
US-20210292348-A1 ANTIVIRAL COMPOUNDS EIF2AK2, MAVS, DUT ACACB 3353/4885MME 491/4885CHRNB2 4873/4885

“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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