SCHEMBL20701469

SCHEMBL20701469

CC(C)OC(=O)N1CCCC(=O)C1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
ABHD6 Q9BV23 4/20 0.33
GPR119 Q8TDV5 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
THRB P10828 1/20 0.32
P2RX4 Q99571 1/20 0.31
CYP2D6 P10635 1/20 0.31
BCHE P06276 1/20 0.31
FAAH O00519 1/20 0.31
SLC6A15 Q9H2J7 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
SCHEMBL7381267 0.89 ABHD6 (0.38) PTGDR2ABHD6GPR119SMN1; SMN2P2RX4
SCHEMBL1983497 0.80 MAPK1 (0.38) SMN1; SMN2MEN1KMT2ATHRBCYP2D6
SCHEMBL3835092 0.79 RAB9A (0.46) PTGDR2MEN1GAAHTTKMT2A
SCHEMBL304030 0.78 LIPE (0.41) GPR119SMN1; SMN2P2RX4CYP2D6BCHE
SCHEMBL6306521 0.77 TSHR (0.44) SMN1; SMN2MEN1GAAHTTKMT2A
SCHEMBL5412873 0.77 ALDH1A1 (0.42) PDE4BGPR119SMN1; SMN2MEN1GAA
SCHEMBL2654623 0.77 TSHR (0.40) PDE4BGPR119SMN1; SMN2MEN1KMT2A
SCHEMBL20215154 0.77 PIK3CD (0.36) SMN1; SMN2MEN1HTTKMT2A
SCHEMBL13160 0.76 ESR2 (0.48) SMN1; SMN2MEN1KMT2ATHRB
SCHEMBL12283406 0.75 ALDH1A1 (0.45) GPR119SMN1; SMN2MEN1GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3661923-B1 N-HETEROCYCLIC COMPOUNDS AS OREXIN 2 AGONISTS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS TAKEDA PHARMACEUTICALS CO (JP) 2024-05-15 EP disclosed
US-20230063805-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-03-02 US disclosed
US-11440883-B2 Heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-09-13 US disclosed
CN-111051295-B Heterocyclic compounds and their use 武田药品工业株式会社 2022-09-02 CN disclosed
US-20200207715-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-07-02 US disclosed
US-20200207734-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-07-02 US disclosed
EP-3661923-A1 HETEROCYCLIC COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2020-06-10 EP disclosed
CN-111051295-A Heterocyclic compounds and their use 武田药品工业株式会社 2020-04-21 CN disclosed
US-10584097-B2 Heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-03-10 US disclosed
US-20200017444-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-01-16 US disclosed
US-10428023-B2 Heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-10-01 US disclosed
WO-2019027058-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-02-07 WO disclosed
US-20190040010-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-02-07 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 (8 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-20190040010-A1 HETEROCYCLIC COMPOUND AND USE THEREOF HCRTR2, HCRTR1, CNR2 PDE4B 1800/4885PTGDR2 416/4885ABHD6 3087/4885
US-20200207734-A1 HETEROCYCLIC COMPOUND AND USE THEREOF HCRTR2, HCRTR1, CNR2 PDE4B 1800/4885PTGDR2 416/4885ABHD6 3087/4885
US-11440883-B2 Heterocyclic compound and use thereof HCRTR2, HCRTR1, CNR2 PDE4B 1800/4885PTGDR2 416/4885ABHD6 3087/4885
US-20230063805-A1 HETEROCYCLIC COMPOUND AND USE THEREOF HCRTR2, HCRTR1, CNR2 PDE4B 1800/4885PTGDR2 416/4885ABHD6 3087/4885
US-10428023-B2 Heterocyclic compound and use thereof HCRTR2, HCRTR1, CNR2 PDE4B 1800/4885PTGDR2 416/4885ABHD6 3087/4885
US-10584097-B2 Heterocyclic compound and use thereof HCRTR2, HCRTR1, CNR2 PDE4B 1800/4885PTGDR2 416/4885ABHD6 3087/4885
US-20200017444-A1 HETEROCYCLIC COMPOUND AND USE THEREOF HCRTR2, HCRTR1, CNR2 PDE4B 1800/4885PTGDR2 416/4885ABHD6 3087/4885
US-20200207715-A1 HETEROCYCLIC COMPOUND AND USE THEREOF HCRTR2, HCRTR1, CNR2 PDE4B 1800/4885PTGDR2 416/4885ABHD6 3087/4885

“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.