SCHEMBL24667632

SCHEMBL24667632

COc1ccc(COc2ccc3c(c2)C(=O)N(c2ccc(=O)n(C)n2)C3)nc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.42
▸ MAP3K5 Q99683 4/20 0.38
▸ PDE10A Q9Y233 2/20 0.37
▸ MCHR1 Q99705 5/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ TNF P01375 2/20 0.35
▸ ADAM17 P78536 3/20 0.35
▸ PRKCA P17252 1/20 0.34
▸ PRKCE Q02156 1/20 0.34

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
SCHEMBL29987068 1.00 GRM5 (0.42) GRM5MAP3K5PDE10AMCHR1SLC6A3
SCHEMBL24667346 0.92 GRM5 (0.42) GRM5PDE10AMCHR1SLC6A3NPC1
SCHEMBL29987375 0.92 GRM5 (0.42) GRM5PDE10AMCHR1SLC6A3NPC1
SCHEMBL24667596 0.90 MAP3K5 (0.37) GRM5MAP3K5MCHR1ADAM17
SCHEMBL24667655 0.89 GRM5 (0.36) GRM5MAP3K5PDE10AMCHR1NPC1
SCHEMBL29986550 0.86 GRM5 (0.42) GRM5PDE10AMCHR1SLC6A3
SCHEMBL24667400 0.86 GRM5 (0.42) GRM5PDE10AMCHR1SLC6A3
SCHEMBL24667405 0.86 GRM5 (0.38) GRM5PDE10ASLC6A3
SCHEMBL24667654 0.86 GRM5 (0.38) GRM5PDE10ASLC6A3
SCHEMBL29987630 0.86 GRM5 (0.38) GRM5PDE10ASLC6A3

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-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 1943/4885MAP3K5 2774/4885PDE10A 3530/4885

“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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