SCHEMBL29336640

SCHEMBL29336640

COCCS(=O)(=O)c1c(Oc2cccc(-c3ncc(C(C)(O)c4ccccc4)[nH]3)c2)c(F)cc2[nH]ccc12

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 3/20 0.32
▸ NR1H3 Q13133 3/20 0.32
▸ DGAT1 O75907 4/20 0.32
▸ GRIN2D O15399 1/20 0.31
▸ GRIN3B O60391 1/20 0.31
▸ GRIN1 Q05586 1/20 0.31
▸ GRIN2A Q12879 1/20 0.31
▸ GRIN2B Q13224 1/20 0.31
▸ GRIN2C Q14957 1/20 0.31
▸ GRIN3A Q8TCU5 1/20 0.31
▸ BACE1 P56817 1/20 0.31
▸ BACE2 Q9Y5Z0 1/20 0.31
▸ BRAF P15056 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
SCHEMBL30285460 1.00 NR1H2 (0.32) NR1H2NR1H3DGAT1GRIN2DGRIN3B
SCHEMBL30285436 0.91 NR1H2 (0.32) NR1H2NR1H3DGAT1GRIN2DGRIN3B
SCHEMBL29336645 0.91 NR1H2 (0.32) NR1H2NR1H3DGAT1GRIN2DGRIN3B
SCHEMBL29336566 0.90 KDM4E (0.35) NR1H2NR1H3DGAT1GRIN2DGRIN3B
SCHEMBL30285379 0.90 KDM4E (0.35) NR1H2NR1H3DGAT1GRIN2DGRIN3B
SCHEMBL29336923 0.87 DGAT1 (0.31) DGAT1
SCHEMBL30285557 0.87 DGAT1 (0.31) DGAT1
SCHEMBL30285304 0.85 NR1H2 (0.31) NR1H2NR1H3DGAT1
SCHEMBL29336919 0.85 NR1H2 (0.31) NR1H2NR1H3DGAT1
SCHEMBL29337131 0.84 GRIN2D (0.34) NR1H2NR1H3DGAT1GRIN2DGRIN3B

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-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION 2024-07-18 — — US disclosed
US-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION 2024-07-18 — — 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-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE CFTR, INMT, IDO1 NR1H2 1753/4885NR1H3 1843/4885DGAT1 2218/4885

“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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