SCHEMBL23828939

SCHEMBL23828939

[2H]C([2H])([2H])C(c1cc(Oc2c(Cl)cc(N)cc2Cl)nnc1Cl)C([2H])([2H])[2H]

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.34
▸ THRA P10827 8/20 0.33
▸ THRB P10828 8/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ UGT1A1 P22309 1/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.33
▸ SLCO1B1 Q9Y6L6 1/20 0.33

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
SCHEMBL29497485 0.91 — —
SCHEMBL13116309 0.90 THRB (0.39) MAPTTHRATHRBCYP2C9UGT1A1
SCHEMBL30820597 0.90 THRB (0.39) MAPTTHRATHRBCYP2C9UGT1A1
SCHEMBL30045685 0.88 THRA (0.31) THRATHRB
SCHEMBL23828958 0.88 MAPT (0.33) MAPTTHRATHRBCYP2C9UGT1A1
SCHEMBL31643227 0.88 MAPT (0.33) MAPTTHRATHRBCYP2C9UGT1A1
SCHEMBL38660363 0.82 THRB (0.40) MAPTTHRATHRBCYP2C9UGT1A1
SCHEMBL22632552 0.82 THRB (0.40) MAPTTHRATHRBCYP2C9UGT1A1
SCHEMBL24032733 0.81 THRB (0.34) MAPTTHRATHRBCYP2C9UGT1A1
SCHEMBL23022535 0.81 THRB (0.35) MAPTTHRATHRBCYP2C9UGT1A1

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-20210292304-A1 DEUTERATED MGL-3196 COMPOUND AND USE THEREOF HINOVA PHARMACEUTICALS INC. (CN) 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-20210292304-A1 DEUTERATED MGL-3196 COMPOUND AND USE THEREOF TSHR, THRA, THRB MAPT 3036/4885THRA 2/4885THRB 3/4885

“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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