SCHEMBL29336584

SCHEMBL29336584

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

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 3/20 0.36
▸ BACE2 Q9Y5Z0 3/20 0.36
▸ NR1H2 P55055 2/20 0.33
▸ NR1H3 Q13133 1/20 0.33
▸ GRIN2D O15399 1/20 0.32
▸ GRIN3B O60391 1/20 0.32
▸ GRIN1 Q05586 1/20 0.32
▸ GRIN2A Q12879 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32
▸ GRIN2C Q14957 1/20 0.32
▸ GRIN3A Q8TCU5 1/20 0.32
▸ SDHB P21912 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ DHODH Q02127 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL30285506 1.00 BACE1 (0.36) BACE1BACE2NR1H2NR1H3GRIN2D
SCHEMBL30285449 0.90 BACE1 (0.37) BACE1BACE2NR1H2NR1H3GRIN2D
SCHEMBL29336583 0.90 BACE1 (0.37) BACE1BACE2NR1H2NR1H3GRIN2D
SCHEMBL30285518 0.81 PIN1 (0.36) BACE1BACE2NR1H2NR1H3GRIN2D
SCHEMBL29336772 0.81 PIN1 (0.36) BACE1BACE2NR1H2NR1H3GRIN2D
SCHEMBL29336940 0.81 BRD4 (0.32) BRD4
SCHEMBL30285454 0.81 BRD4 (0.32) BRD4
SCHEMBL29336566 0.80 KDM4E (0.35) BACE1BACE2NR1H2NR1H3GRIN2D
SCHEMBL30285379 0.80 KDM4E (0.35) BACE1BACE2NR1H2NR1H3GRIN2D
SCHEMBL29336768 0.77 GRIN2D (0.33) BACE1BACE2GRIN2DGRIN3BGRIN1

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 BACE1 3871/4885BACE2 3643/4885NR1H2 1753/4885

“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.

Send feedback