SCHEMBL4439030

SCHEMBL4439030

[CH2]CCC(=O)C1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
NOS2 P35228 1/20 0.35
TSHR P16473 2/20 0.34
ALDH1A1 P00352 1/20 0.34
EPHX1 P07099 1/20 0.34
HSD11B1 P28845 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HSD17B10 Q99714 1/20 0.33
GAA P10253 1/20 0.31
RECQL P46063 1/20 0.30

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
SCHEMBL4813468 0.98 CES2 (0.46) CES2CES1HDAC8HDAC6NOS2
SCHEMBL29056275 0.95
SCHEMBL10683868 0.90 KMT2A (0.33)
SCHEMBL28735265 0.90
SCHEMBL6248920 0.86 CES2 (0.39) CES2CES1HDAC8HDAC6NOS2
SCHEMBL29165191 0.84 SMN1; SMN2 (0.38) CES2CES1HDAC8HDAC6NOS2
SCHEMBL29056312 0.84 CES2 (0.42) CES2CES1HDAC8HDAC6NOS2
SCHEMBL29056296 0.81 CES2 (0.33) CES2CES1NOS2SMN1; SMN2
SCHEMBL7714802 0.78 CES2 (0.43) CES2CES1HDAC8HDAC6NOS2
SCHEMBL23727961 0.77 CES2 (0.43) CES2CES1HDAC8HDAC6NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116640157-A METTL3 inhibitor and composition thereof and application of METTL3 inhibitor and composition thereof in medicine 海思科医药集团股份有限公司 2023-08-25 CN claimed
CN-118339168-A Fused ring heterocyclic derivative and application thereof in medicine 西藏海思科制药有限公司 2024-07-12 CN disclosed
CN-116640157-A METTL3 inhibitor and composition thereof and application of METTL3 inhibitor and composition thereof in medicine 海思科医药集团股份有限公司 2023-08-25 CN disclosed
CN-101801972-A Pyrazolo [1,5-A]pyrimidines as inhibitors of stearoyl-coA desaturase INOVACIA AB 2010-08-11 CN disclosed
EP-2137187-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE Inovacia AB (SE) 2009-12-30 EP disclosed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
WO-2008116898-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE BIOVITRUM AB (PUBL) (SE) 2008-10-02 WO disclosed
EP-0686636-B1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA CO (JP) 2001-04-04 EP disclosed
US-5840895-A INTERMEDIATES FOR ANTIALLERGENS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1998-11-24 US disclosed
US-5686442-A ANTIALLERGENS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-11-11 US disclosed
EP-0686636-A1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-12-13 EP 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-20080255153-A1 New compounds SCD, SCD5, FADS2 CES2 1198/4885CES1 120/4885HDAC8 1029/4885

“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.