SCHEMBL29868029

SCHEMBL29868029

CN(C(=O)OCCl)c1ncccc1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.38
▸ CHRM2 P08172 2/20 0.33
▸ CHRM4 P08173 2/20 0.33
▸ CHRM5 P08912 2/20 0.33
▸ CHRM1 P11229 2/20 0.33
▸ CHRM3 P20309 2/20 0.33
▸ CASP3 P42574 2/20 0.32
▸ SENP8 Q96LD8 2/20 0.32
▸ SENP7 Q9BQF6 2/20 0.32
▸ SENP6 Q9GZR1 2/20 0.32
▸ TACR1 P25103 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ TRPV1 Q8NER1 1/20 0.30
▸ HSD17B1 P14061 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
SCHEMBL23084701 1.00 BACE1 (0.38) BACE1CHRM2CHRM4CHRM5CHRM1
SCHEMBL21122067 0.84 BACE1 (0.41) BACE1CHRM2CHRM4CHRM5CHRM1
SCHEMBL29868015 0.81 MEN1 (0.38) CASP3SENP8SENP7SENP6ALDH1A1
SCHEMBL23084702 0.81 MEN1 (0.38) CASP3SENP8SENP7SENP6ALDH1A1
SCHEMBL30270924 0.79 CHRM2 (0.32) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL31172125 0.78 CASP3 (0.33) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL22636487 0.78 CASP3 (0.33) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL23698605 0.77 HTT (0.35) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL23698705 0.76 ALDH1A1 (0.35) CASP3SENP8SENP7SENP6ALDH1A1
SCHEMBL23084799 0.75 POLB (0.38) CASP3SENP8SENP7SENP6ALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11447449-B2 Inhibitors of indoleamine 2,3-dioxygenase and methods of their use BRISTOL-MYERS SQUIBB COMPANY (US) 2022-09-20 — — 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 (1 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-11447449-B2 Inhibitors of indoleamine 2,3-dioxygenase and methods of their use IDO1, IDO2, INMT BACE1 2491/4885CHRM2 1793/4885CHRM4 3623/4885

“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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