SCHEMBL4566630

SCHEMBL4566630

NC(=O)OC1CCCOC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.36
EPHX1 P07099 1/20 0.33
GRM5 P41594 2/20 0.32
ACACB O00763 1/20 0.32
MAPK8 P45983 1/20 0.31
MAPK9 P45984 1/20 0.31
PDE4A P27815 2/20 0.31
PDE4B Q07343 2/20 0.31
PDE4C Q08493 2/20 0.31
PDE4D Q08499 2/20 0.31
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
PARP10 Q53GL7 1/20 0.30
NAAA Q02083 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
SCHEMBL22356126 0.88
SCHEMBL2239226 0.88
SCHEMBL19558723 0.88
SCHEMBL4691011 0.82 EPHX1 (0.34) EPHX1GRM5ACACBNAAA
SCHEMBL18319305 0.80 GRM5 (0.34) EPHX1GRM5ACACBNAAA
SCHEMBL4539270 0.80 ACACB (0.36) EPHX1GRM5ACACBNAAA
SCHEMBL16782377 0.80 ACACB (0.36) EPHX1GRM5ACACBNAAA
SCHEMBL8196802 0.80 EPHX1 (0.33) EPHX1GRM5ACACBJAK2JAK1
SCHEMBL28360817 0.78 CHRM2 (0.33) EPHX1GRM5ACACB
SCHEMBL13829862 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109689664-B Tricyclic heteroaryl substituted quinoline and azaquinoline compounds as PAR4 inhibitors 百时美施贵宝公司 2022-04-15 CN claimed
US-12312362-B2 Spiro derivatives of Alpha-D-galactopyranosides IDORSIA PHARMACEUTICALS LTD (CH) 2025-05-27 US disclosed
US-20230295182-A1 SPIRO DERIVATIVES OF ALPHA-D-GALACTOPYRANOSIDES IDORSIA PHARMACEUTICALS LTD (CH) 2023-09-21 US disclosed
CN-109689664-B Tricyclic heteroaryl substituted quinoline and azaquinoline compounds as PAR4 inhibitors 百时美施贵宝公司 2022-04-15 CN disclosed
EP-2094081-A1 TRICYCLIC HETEROAROMATIC COMPOUNDS AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES Merck & Co., Inc. (US) 2009-09-02 EP disclosed
WO-2008060488-A1 TRICYCLIC HETEROAROMATIC COMPOUNDS AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES MERCK & CO., INC. (US) 2008-05-22 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-12312362-B2 Spiro derivatives of Alpha-D-galactopyranosides LGALS1, LGALS3, LGALS2 ATM 3792/4885EPHX1 4305/4885GRM5 2832/4885
US-20230295182-A1 SPIRO DERIVATIVES OF ALPHA-D-GALACTOPYRANOSIDES LGALS1, LGALS3, LGALS2 ATM 3792/4885EPHX1 4305/4885GRM5 2832/4885

“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.