SCHEMBL24667307

SCHEMBL24667307

COc1ccc(COc2cc(F)c3c(c2)CN(c2ccc(=O)[nH]n2)C3=O)nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.38
▸ HRH3 Q9Y5N1 2/20 0.35
▸ CSNK1A1 P48729 2/20 0.34
▸ CSNK1D P48730 2/20 0.34
▸ GSK3B P49841 2/20 0.34
▸ CSNK1G2 P78368 2/20 0.34
▸ CSF1R P07333 1/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ MCHR1 Q99705 5/20 0.32
▸ POLB P06746 1/20 0.31
▸ AKR1B1 P15121 1/20 0.31
▸ HTR2C P28335 1/20 0.31
▸ TIPARP Q7Z3E1 1/20 0.31

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
SCHEMBL29987867 1.00 GRM5 (0.38) GRM5HRH3CSNK1A1CSNK1DGSK3B
SCHEMBL24667777 0.86 GRM5 (0.39) GRM5HRH3CSNK1A1CSNK1DGSK3B
SCHEMBL29986601 0.86 GRM5 (0.39) GRM5HRH3CSNK1A1CSNK1DGSK3B
SCHEMBL29987263 0.85 GRM5 (0.40) GRM5HRH3CSF1RNPC1RAB9A
SCHEMBL24667376 0.85 GRM5 (0.40) GRM5HRH3CSF1RNPC1RAB9A
SCHEMBL24667378 0.84 GRM5 (0.40) GRM5HRH3CSNK1A1CSNK1DGSK3B
SCHEMBL29987385 0.84 GRM5 (0.40) GRM5HRH3CSNK1A1CSNK1DGSK3B
SCHEMBL24667401 0.83 GRM5 (0.36) GRM5HRH3CSNK1A1CSNK1DGSK3B
SCHEMBL24667583 0.83 GRM5 (0.36) GRM5HRH3CSNK1A1CSNK1DGSK3B
SCHEMBL29986758 0.83 GRM5 (0.36) GRM5HRH3CSNK1A1CSNK1DGSK3B

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 1943/4885HRH3 3604/4885CSNK1A1 2581/4885

“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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