SCHEMBL21618544

SCHEMBL21618544

Cc1n[nH]c(C)c1CCCOc1cc(CC(C)(C)C)ccc1F

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 4/20 0.62
▸ ALB P02768 1/20 0.62
▸ HSD17B10 Q99714 8/20 0.51
▸ SMN1; SMN2 Q16637 7/20 0.51
▸ MAPT P10636 5/20 0.51
▸ GAA P10253 1/20 0.51
▸ LMNA P02545 6/20 0.48
▸ HTT P42858 4/20 0.48
▸ TSHR P16473 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ MEN1 O00255 5/20 0.48
▸ KMT2A Q03164 5/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPK1 P28482 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.44

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
SCHEMBL25129906 0.84 TTR (0.62) TTRALBHSD17B10SMN1; SMN2MAPT
SCHEMBL15828247 0.83 TTR (0.71) TTRALBHSD17B10SMN1; SMN2MAPT
SCHEMBL24953182 0.80 TTR (0.67) TTRALBHSD17B10SMN1; SMN2MAPT
SCHEMBL20145409 0.79 TTR (0.69) TTRALBHSD17B10SMN1; SMN2MAPT
SCHEMBL15158388 0.77 TTR (1.00) TTRALBHSD17B10SMN1; SMN2MAPT
SCHEMBL24953188 0.77 TTR (0.83) TTRALBHSD17B10SMN1; SMN2MAPT
Acoramidis SCHEMBL29350324 0.77 TTR (1.00) TTRALBHSD17B10SMN1; SMN2MAPT
Acoramidis SCHEMBL15816954 0.77 TTR (1.00) TTRALBHSD17B10SMN1; SMN2MAPT
Acoramidis SCHEMBL20475239 0.76 TTR (0.98) TTRALBHSD17B10SMN1; SMN2MAPT
SCHEMBL20463047 0.76 TTR (0.64) TTRALBHSD17B10SMN1; SMN2MAPT

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-11337935-B2 Identification of stabilizers of multimeric proteins THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2022-05-24 — — US disclosed
US-20200016098-A1 Identification of Stabilizers of Multimeric Proteins THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2020-01-16 — — 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-11337935-B2 Identification of stabilizers of multimeric proteins TTR, HSPBP1, HSPH1 TTR 1/4885ALB 11/4885HSD17B10 3054/4885
US-20200016098-A1 Identification of Stabilizers of Multimeric Proteins TTR, HSPBP1, HSPH1 TTR 1/4885ALB 11/4885HSD17B10 3054/4885

“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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