SCHEMBL21749425

SCHEMBL21749425

COc1ccc(Cn2nc(Cc3c(Cl)cc(N(C/C(N)=N\O)C(=O)O)cc3Cl)cc(C(C)C)c2=O)cc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 10/20 0.37
▸ THRA P10827 3/20 0.35
▸ THRB P10828 3/20 0.35
▸ ASIC1 P78348 2/20 0.33
▸ MCHR1 Q99705 1/20 0.33
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ SLC16A3 O15427 1/20 0.32
▸ SLC16A1 P53985 1/20 0.32
▸ MCTS1 Q9ULC4 1/20 0.32

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
SCHEMBL21749428 1.00 NPBWR1 (0.37) NPBWR1THRATHRBASIC1MCHR1
SCHEMBL21769494 0.90 NPBWR1 (0.35) NPBWR1THRATHRBASIC1MCHR1
SCHEMBL21749466 0.85 NPBWR1 (0.38) NPBWR1THRATHRBMCHR1CYP2C9
SCHEMBL21749362 0.84 THRB (0.45) THRATHRB
SCHEMBL21749363 0.84 THRB (0.45) THRATHRB
SCHEMBL28566985 0.80 NPBWR1 (0.43) NPBWR1THRATHRBMCHR1CYP3A4
SCHEMBL21749429 0.80 NPBWR1 (0.36) NPBWR1THRATHRB
SCHEMBL21749369 0.80 THRA (0.38) NPBWR1THRATHRB
SCHEMBL21749380 0.79 NPBWR1 (0.47) NPBWR1THRATHRBMCHR1
SCHEMBL21769493 0.77 NPBWR1 (0.36) NPBWR1THRATHRBMCHR1SLC16A3

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 NPBWR1 158/4885THRA 2/4885THRB 1/4885
US-10800767-B2 Thyroid hormone receptor beta agonist compounds THRB, THRA, TSHR NPBWR1 158/4885THRA 2/4885THRB 1/4885

“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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