SCHEMBL24667378

SCHEMBL24667378

COc1ccc(COc2cc(F)c3c(c2)CN(c2ccc(=O)n(C)n2)C3=O)nc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.34
▸ MCHR1 Q99705 10/20 0.34
▸ PDE10A Q9Y233 1/20 0.34
▸ HTR2C P28335 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ CSNK1A1 P48729 1/20 0.33
▸ CSNK1D P48730 1/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ CSNK1G2 P78368 1/20 0.33
▸ HRH3 Q9Y5N1 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
SCHEMBL29987385 1.00 GRM5 (0.40) GRM5SLC6A3MCHR1PDE10AHTR2C
SCHEMBL24667398 0.86 GRM5 (0.40) GRM5SLC6A3MCHR1PDE10ACSNK1A1
SCHEMBL29987322 0.86 GRM5 (0.40) GRM5SLC6A3MCHR1PDE10ACSNK1A1
SCHEMBL29986550 0.85 GRM5 (0.42) GRM5SLC6A3MCHR1PDE10ACYP3A4
SCHEMBL24667346 0.85 GRM5 (0.42) GRM5SLC6A3MCHR1PDE10AHRH3
SCHEMBL29987375 0.85 GRM5 (0.42) GRM5SLC6A3MCHR1PDE10AHRH3
SCHEMBL24667400 0.85 GRM5 (0.42) GRM5SLC6A3MCHR1PDE10ACYP3A4
SCHEMBL24667307 0.84 GRM5 (0.38) GRM5MCHR1HTR2CCSNK1A1CSNK1D
SCHEMBL29987867 0.84 GRM5 (0.38) GRM5MCHR1HTR2CCSNK1A1CSNK1D
SCHEMBL24667390 0.84 NPC1 (0.40) GRM5HTR2C

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
CN-117412960-A Isoindolinone compounds and imaging agents for imaging huntingtin CHDI基金会股份有限公司 2024-01-16 — — CN disclosed
US-20220339302-A1 ISOINDOLINONE COMPOUNDS AND IMAGING AGENTS FOR IMAGING HUNTINGTIN PROTEIN CHDI FOUNDATION, INC. 2022-10-27 — — 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 (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-20220339302-A1 ISOINDOLINONE COMPOUNDS AND IMAGING AGENTS FOR IMAGING HUNTINGTIN PROTEIN HTT, HYPK, HSPBP1 GRM5 1943/4885SLC6A3 1916/4885MCHR1 1633/4885

“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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