SCHEMBL23844568

SCHEMBL23844568

CC(C)C(=O)CCCn1ccnc1

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 17/20 0.57
EGLN3 Q9H6Z9 1/20 0.54
QPCT Q16769 1/20 0.51

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
SCHEMBL8640926 0.90 EGLN3 (0.62) TBXAS1EGLN3
SCHEMBL6165743 0.81 TBXAS1 (0.62) TBXAS1EGLN3
SCHEMBL12391736 0.80 ALDH1A1 (0.62) TBXAS1EGLN3
SCHEMBL4395522 0.79 TBXAS1 (0.64) TBXAS1EGLN3
SCHEMBL2436663 0.79 TBXAS1 (0.86) TBXAS1EGLN3
SCHEMBL1828857 0.79 TBXAS1 (0.64) TBXAS1EGLN3
SCHEMBL47372 0.78 EGLN3 (0.61) TBXAS1EGLN3
SCHEMBL24040195 0.78 TBXAS1 (0.58) TBXAS1EGLN3
Hydrochloric Acid SCHEMBL8891869 0.77 TBXAS1 (0.87) TBXAS1EGLN3
SCHEMBL26118476 0.77 TBXAS1 (0.62) TBXAS1EGLN3

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-20210292300-A1 DIMETHOXYPHENYL SUBSTITUTED INDOLE COMPOUNDS AS TLR7, TLR8 OR TLR9 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 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 (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-20210292300-A1 DIMETHOXYPHENYL SUBSTITUTED INDOLE COMPOUNDS AS TLR7, TLR8 OR TLR9 INHIBITORS TLR9, TLR7, TLR8 TBXAS1 1361/4885EGLN3 2500/4885QPCT 3661/4885

“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.