SCHEMBL13359381

SCHEMBL13359381

COC(C)C(=O)N1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
HPGD P15428 2/20 0.51
ALOX15 P16050 1/20 0.51
HSD17B10 Q99714 1/20 0.51
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
GAA P10253 2/20 0.49
PKM P14618 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
TSHR P16473 2/20 0.44
KMT2A Q03164 1/20 0.44
PTGS2 P35354 1/20 0.44
KDM4E B2RXH2 2/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL17901790 1.00 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2HPGDALOX15HSD17B10
SCHEMBL13359380 0.85 HPGD (0.41) ALDH1A1SMN1; SMN2HPGDALOX15HSD17B10
SCHEMBL13324904 0.82 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2HPGDALOX15HSD17B10
SCHEMBL10350673 0.82 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2HPGDALOX15HSD17B10
SCHEMBL14159619 0.81 SMN1; SMN2 (0.43) ALDH1A1SMN1; SMN2HPGDALOX15HSD17B10
SCHEMBL12539736 0.81 DPP4 (0.40) ALDH1A1SMN1; SMN2HPGDL3MBTL1KMT2A
SCHEMBL12199290 0.81 CYP3A4 (0.47) ALDH1A1SMN1; SMN2HPGDALOX15HSD17B10
SCHEMBL20311441 0.79 CYP3A4 (0.58) ALDH1A1SMN1; SMN2HPGDALOX15HSD17B10
SCHEMBL738198 0.79 SMN1; SMN2 (0.54) ALDH1A1SMN1; SMN2HPGDALOX15HSD17B10
SCHEMBL18292237 0.78 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2HPGDALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250034141-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-01-30 US disclosed
US-12152027-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-11-26 US disclosed
CN-118420620-A Heterocyclic compounds 武田药品工业株式会社 2024-08-02 CN disclosed
CN-113038948-B Heterocyclic compounds 武田药品工业株式会社 2024-07-12 CN disclosed
US-11897879-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-02-13 US disclosed
US-20230192685-A1 METHOD FOR PRODUCING HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-06-22 US disclosed
US-20230192685-A1 METHOD FOR PRODUCING HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-06-22 US disclosed
US-20220089595-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2022-03-24 US disclosed
US-20220048916-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-02-17 US disclosed
US-11230545-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-01-25 US disclosed
US-20210332045-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-10-28 US disclosed
EP-3888652-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2021-10-06 EP disclosed
CN-113038948-A Heterocyclic compounds 武田药品工业株式会社 2021-06-25 CN disclosed
US-7714131-B2 Process for the stereoselective preparation of (−)-halofenate and derivatives thereof METABOLEX, INC. (US) 2010-05-11 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-20220089595-A1 HETEROCYCLIC COMPOUND MALT1, SQSTM1, PPM1D ALDH1A1 1199/4885SMN1; SMN2 2190/4885HPGD 1900/4885
US-20250034141-A1 HETEROCYCLIC COMPOUND MALT1, SQSTM1, PPM1D ALDH1A1 1199/4885SMN1; SMN2 2190/4885HPGD 1900/4885
US-11230545-B2 Heterocyclic compound MALT1, SQSTM1, PPM1D ALDH1A1 1199/4885SMN1; SMN2 2190/4885HPGD 1900/4885
US-20210332045-A1 HETEROCYCLIC COMPOUND MALT1, SQSTM1, PPM1D ALDH1A1 1199/4885SMN1; SMN2 2190/4885HPGD 1900/4885
US-20230192685-A1 METHOD FOR PRODUCING HETEROCYCLIC COMPOUND MALT1, CYP51A1, ME1 ALDH1A1 1289/4885SMN1; SMN2 3090/4885HPGD 2780/4885
US-12152027-B2 Heterocyclic compound MALT1, SQSTM1, PPM1D ALDH1A1 1199/4885SMN1; SMN2 2190/4885HPGD 1900/4885
US-20220048916-A1 HETEROCYCLIC COMPOUND MALT1, SQSTM1, PPM1D ALDH1A1 1199/4885SMN1; SMN2 2190/4885HPGD 1900/4885
US-11897879-B2 Heterocyclic compound MALT1, SQSTM1, PPM1D ALDH1A1 1199/4885SMN1; SMN2 2190/4885HPGD 1900/4885

“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.