SCHEMBL21569747

SCHEMBL21569747

CN1CCC(NC(=O)C2CCN(C(C)(C)C)CC2)C1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 6/20 0.41
SSTR1 P30872 4/20 0.41
KDM5A P29375 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
TSHR P16473 1/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
EPHX2 P34913 3/20 0.37
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36

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
SCHEMBL21569681 0.91 L3MBTL1 (0.43) SSTR4SSTR1L3MBTL1TSHRGAA
SCHEMBL21569624 0.91 GAA (0.40) L3MBTL1TSHRGAAMEN1RAB9A
SCHEMBL26140448 0.87 L3MBTL1 (0.47) L3MBTL1TSHRGAAMEN1RAB9A
SCHEMBL14472719 0.87 KDM5A (0.45) SSTR4SSTR1KDM5AL3MBTL1TSHR
SCHEMBL1908725 0.85 KDM5A (0.49) SSTR4SSTR1KDM5AL3MBTL1TSHR
SCHEMBL21037723 0.85 KDM5A (0.49) SSTR4SSTR1KDM5AL3MBTL1TSHR
SCHEMBL13242299 0.85 KDM5A (0.49) SSTR4SSTR1KDM5AL3MBTL1TSHR
SCHEMBL16072922 0.84 KDM5A (0.47) KDM5AL3MBTL1TSHRMEN1RAB9A
SCHEMBL16992001 0.84 MAPK1 (0.49) L3MBTL1TSHRGAAMEN1RAB9A
SCHEMBL10205067 0.84 POLB (0.48) KDM5AL3MBTL1TSHRGAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11827641-B2 Toll-like receptor antagonist compounds and methods of use DYNAVAX TECHNOLOGIES CORPORATION (US) 2023-11-28 US disclosed
US-11827641-B2 Toll-like receptor antagonist compounds and methods of use DYNAVAX TECHNOLOGIES CORPORATION (US) 2023-11-28 US disclosed
US-11370794-B2 Toll-like receptor antagonist compounds and methods of use DYNAVAX TECHNOLOGIES CORPORATION (US) 2022-06-28 US disclosed
US-20190345161-A1 TOLL-LIKE RECEPTOR ANTAGONIST COMPOUNDS AND METHODS OF USE DYNAVAX TECHNOLOGIES CORPORATION (US) 2019-11-14 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 (3 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-11827641-B2 Toll-like receptor antagonist compounds and methods of use TLR7, TLR9, TLR1 SSTR4 1126/4885SSTR1 785/4885KDM5A 1074/4885
US-20190345161-A1 TOLL-LIKE RECEPTOR ANTAGONIST COMPOUNDS AND METHODS OF USE TLR7, TLR9, TLR1 SSTR4 1126/4885SSTR1 785/4885KDM5A 1074/4885
US-11370794-B2 Toll-like receptor antagonist compounds and methods of use TLR9, TLR7, TLR8 SSTR4 919/4885SSTR1 582/4885KDM5A 689/4885

“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.