SCHEMBL21769501

SCHEMBL21769501

CC(c1noc(=O)[nH]1)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTH P32929 1/20 0.37
RARB P10826 1/20 0.33
PTGER3 P43115 1/20 0.33
DDAH1 O94760 1/20 0.31
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL19859659 0.76 CTH (0.41) CTHPTGER3DDAH1THRATHRB
SCHEMBL19859661 0.76 CTH (0.41) CTHPTGER3DDAH1THRATHRB
SCHEMBL14211480 0.76 CTH (0.34) CTHRARBDDAH1ALDH1A1
SCHEMBL22924681 0.75
SCHEMBL21649800 0.75
SCHEMBL8264869 0.75
SCHEMBL24443097 0.71 CTH (0.36) CTHPTGER3DDAH1THRATHRB
SCHEMBL20651769 0.71 CTH (0.36) CTHPTGER3DDAH1THRATHRB
SCHEMBL2398361 0.69 CTH (0.39) CTHDDAH1ALDH1A1MAPTHPGD
SCHEMBL19859504 0.68 KMT2A (0.36) CTHDDAH1THRATHRBALDH1A1

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-10800767-B2 Thyroid hormone receptor beta agonist compounds Terns, Inc. (US) 2020-10-13 US disclosed
US-20200062742-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS Terns, Inc. 2020-02-27 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-20200062742-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS THRB, THRA, TSHR CTH 551/4885RARB 226/4885PTGER3 435/4885
US-10800767-B2 Thyroid hormone receptor beta agonist compounds THRB, THRA, TSHR CTH 551/4885RARB 226/4885PTGER3 435/4885

“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.