SCHEMBL29986758

SCHEMBL29986758

COc1ccc(COc2cc3c(cc2F)C(=O)N(c2ccc(=O)[nH]n2)C3)nc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.36
▸ HRH3 Q9Y5N1 2/20 0.35
▸ CSF1R P07333 1/20 0.35
▸ CSNK1A1 P48729 4/20 0.34
▸ CSNK1D P48730 4/20 0.34
▸ GSK3B P49841 4/20 0.34
▸ CSNK1G2 P78368 4/20 0.34
▸ IKZF2 Q9UKS7 1/20 0.33
▸ PIK3CG P48736 2/20 0.33
▸ PDE10A Q9Y233 1/20 0.32
▸ FGFR1 P11362 1/20 0.32
▸ FGFR2 P21802 1/20 0.32
▸ FGFR3 P22607 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ GYS1 P13807 1/20 0.32

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
SCHEMBL24667583 1.00 GRM5 (0.36) GRM5HRH3CSF1RCSNK1A1CSNK1D
SCHEMBL24667401 0.96 GRM5 (0.36) GRM5HRH3CSF1RCSNK1A1CSNK1D
SCHEMBL29987383 0.96 GRM5 (0.36) GRM5HRH3CSF1RCSNK1A1CSNK1D
SCHEMBL29987263 0.86 GRM5 (0.40) GRM5HRH3CSF1RIKZF2PIK3CG
SCHEMBL24667376 0.86 GRM5 (0.40) GRM5HRH3CSF1RIKZF2PIK3CG
SCHEMBL29165247 0.86 GRM5 (0.43) GRM5CSF1RCSNK1A1CSNK1DGSK3B
SCHEMBL24667654 0.84 GRM5 (0.38) GRM5HRH3CSF1RCSNK1A1CSNK1D
SCHEMBL29987630 0.84 GRM5 (0.38) GRM5HRH3CSF1RCSNK1A1CSNK1D
SCHEMBL24667777 0.84 GRM5 (0.39) GRM5HRH3CSF1RCSNK1A1CSNK1D
SCHEMBL29986601 0.84 GRM5 (0.39) GRM5HRH3CSF1RCSNK1A1CSNK1D

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4320114-A1 ISOINDOLINONE COMPOUNDS AND IMAGING AGENTS FOR IMAGING HUNTINGTIN PROTEIN CHDI Foundation, Inc. (US) 2024-02-14 — — EP disclosed
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
WO-2022216947-A1 ISOINDOLINONE COMPOUNDS AND IMAGING AGENTS FOR IMAGING HUNTINGTIN PROTEIN CHDI FOUNDATION, INC. (US) 2022-10-13 — — WO disclosed
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