SCHEMBL24360474

SCHEMBL24360474

CCCCCC(CCCC)C(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.50
CA1 P00915 4/20 0.50
MAPK1 P28482 1/20 0.45
CTSK P43235 3/20 0.43
ZDHHC7 Q9NXF8 1/20 0.43
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
SLC1A2 P43004 1/20 0.42
SLC1A1 P43005 1/20 0.42
CTSS P25774 1/20 0.41
SMPD1 P17405 3/20 0.40

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
SCHEMBL21259199 0.98 CA2 (0.53) CA2CA1MAPK1CTSKZDHHC7
SCHEMBL22035852 0.98 CA2 (0.53) CA2CA1MAPK1CTSKZDHHC7
SCHEMBL31235985 0.98 CA2 (0.53) CA2CA1MAPK1CTSKZDHHC7
SCHEMBL22880855 0.96 CA2 (0.50) CA2CA1ZDHHC7GRIK1GRIK2
SCHEMBL18597124 0.96 CA2 (0.50) CA2CA1ZDHHC7GRIK1GRIK2
SCHEMBL28380817 0.96 CA2 (0.50) CA2CA1ZDHHC7GRIK1GRIK2
SCHEMBL7367485 0.96 CA2 (0.50) CA2CA1ZDHHC7GRIK1GRIK2
SCHEMBL18597120 0.96 CA2 (0.50) CA2CA1ZDHHC7GRIK1GRIK2
SCHEMBL28664768 0.96 CA2 (0.50) CA2CA1ZDHHC7GRIK1GRIK2
SCHEMBL28381502 0.96 CA2 (0.50) CA2CA1ZDHHC7GRIK1GRIK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118201916-A Piperazinylsulfonylaryl compounds for the treatment of bacterial infections 豪夫迈·罗氏有限公司 2024-06-14 CN disclosed
CN-111278840-B Pyrrolo [2,3-B ] pyridine compounds and their use for the treatment of cancer 癌症研究科技有限公司 2023-11-17 CN disclosed
CN-116685576-A Cysteine protease inhibitors and methods of use thereof 美商帕迪斯生物科学公司 2023-09-01 CN disclosed
CN-115362153-A Aza spiro rings as monoacylglycerol lipase modulators 詹森药业有限公司 2022-11-18 CN disclosed
US-20220340577-A1 GCN2 INHIBITORS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2022-10-27 US disclosed
CN-114746151-A Aryl heterocyclic compounds as Kv1.3 potassium Shaker channel blockers D·E·萧尔研究有限责任公司 2022-07-12 CN disclosed
US-20220127754-A1 METHODS AND COMPOSITIONS OF ACCELERATING REACTIONS FOR POLYPEPTIDE ANALYSIS AND RELATED USES Encodia, Inc. (US) 2022-04-28 US disclosed
CN-112218866-A Spiro-lactam NMDA receptor modulators and uses thereof 阿普廷伊克斯股份有限公司 2021-01-12 CN disclosed
CN-111278840-A Pyrrolo [2, 3-B ] pyridine compounds and their use for treating cancer 癌症研究科技有限公司 2020-06-12 CN 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-20220340577-A1 GCN2 INHIBITORS AND USES THEREOF EIF2AK4, GCN1, GCGR CA2 1674/4885CA1 4106/4885MAPK1 3282/4885

“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.