SCHEMBL14809451

SCHEMBL14809451

CC(C)(C)[S@@+]([O-])N=Cc1ccc(F)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.45
GRIN3B O60391 2/20 0.45
GRIN1 Q05586 2/20 0.45
GRIN2A Q12879 2/20 0.45
GRIN2B Q13224 2/20 0.45
GRIN2C Q14957 2/20 0.45
GRIN3A Q8TCU5 2/20 0.45
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
NFE2L2 Q16236 4/20 0.39
ACHE P22303 2/20 0.36
BACE1 P56817 2/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
BCHE P06276 1/20 0.34
HTR2A P28223 1/20 0.33
HTR2C P28335 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
SCHEMBL12525147 1.00 GRIN2D (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1890675 1.00 GRIN2D (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL14809450 1.00 GRIN2D (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL14809805 1.00 GRIN2D (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1890678 1.00 GRIN2D (0.45) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL23948343 0.87 NFE2L2 (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL19617712 0.87 NFE2L2 (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29618134 0.87 NFE2L2 (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL23070616 0.87 NFE2L2 (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL19617713 0.87 NFE2L2 (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240294500-A1 ISOINDOLINONE COMPOUNDS, AND USES THEREOF HANGZHOU GLUBIO PHARMACEUTICAL CO., LTD. (CN) 2024-09-05 US disclosed
EP-4352046-A1 ISOINDOLINONE COMPOUNDS, AND USES THEREOF Hangzhou Glubio Pharmaceutical Co., Ltd. (CN) 2024-04-17 EP disclosed
CN-117561244-A Isoindolinone compounds and uses thereof 杭州格博生物医药有限公司 2024-02-13 CN disclosed
WO-2022257897-A1 ISOINDOLINONE COMPOUNDS, AND USES THEREOF HANGZHOU GLUBIO PHARMACEUTICAL CO., LTD. (CN) 2022-12-15 WO disclosed
EP-2758059-B1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME (US) 2018-10-24 EP disclosed
US-9079930-B2 Substituted pyrimidines MERCK SHARP & DOHME CORP. (US) 2015-07-14 US disclosed
US-20140349972-A1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME CORP (US) 2014-11-27 US disclosed
EP-2758059-A1 SUBSTITUTED PYRIMIDINES Merck Sharp & Dohme Corp. (US) 2014-07-30 EP disclosed
WO-2013040790-A1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME CORP. (US) 2013-03-28 WO disclosed
WO-2013043624-A1 SUBSTITUTED PYRIMIDINES MERCK SHARP & DOHME CORP. (US) 2013-03-28 WO 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 (2 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-20240294500-A1 ISOINDOLINONE COMPOUNDS, AND USES THEREOF PKD1, SLC10A1, TP53 GRIN2D 2307/4885GRIN3B 3672/4885GRIN1 2851/4885
US-20140349972-A1 SUBSTITUTED PYRIMIDINES HIF1AN, HIF1A, EGLN3 GRIN2D 4729/4885GRIN3B 4604/4885GRIN1 4660/4885

“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.