SCHEMBL10316643

SCHEMBL10316643

CS(=O)(=O)OCCOCCOCCOCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA9 Q16790 2/20 0.47
NAAA Q02083 1/20 0.46
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 2/20 0.41
NPC1 O15118 1/20 0.41
AR P10275 1/20 0.41
RAB9A P51151 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 4/20 0.39
HTT P42858 2/20 0.39
AGTR1 P30556 1/20 0.39
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
MMP9 P14780 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL6379981 1.00 TSHR (0.48) TSHRCA1CA2CA9NAAA
SCHEMBL25622617 1.00 TSHR (0.48) TSHRCA1CA2CA9NAAA
SCHEMBL12013298 1.00 TSHR (0.48) TSHRCA1CA2CA9NAAA
SCHEMBL30388469 1.00 TSHR (0.48) TSHRCA1CA2CA9NAAA
SCHEMBL2076848 0.98 TSHR (0.50) TSHRCA1CA2CA9NAAA
SCHEMBL24773083 0.95 TSHR (0.44) TSHRCA1CA2CA9NAAA
SCHEMBL27032384 0.95 TSHR (0.44) TSHRCA1CA2CA9NAAA
SCHEMBL29198550 0.95 L3MBTL1 (0.47) TSHRCA1CA2CA9NAAA
SCHEMBL2568738 0.94 L3MBTL1 (0.49) TSHRCA1CA2CA9NAAA
SCHEMBL20133100 0.90 L3MBTL1 (0.49) TSHRCA1CA2CA9NAAA

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12202829-B2 Heterocyclic compound FIMECS, INC. (JP) 2025-01-21 US disclosed
US-20240246992-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS SERVIER LAB (FR) 2024-07-25 US disclosed
EP-4308570-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS Les Laboratoires Servier (FR) 2024-01-24 EP disclosed
CN-117425661-A Macrocyclic LRRK2 kinase inhibitors 法国施维雅药厂 2024-01-19 CN disclosed
US-20230242529-A1 HETEROCYCLIC COMPOUND FIMECS, INC. (JP) 2023-08-03 US disclosed
EP-3609889-B1 SMALL MOLECULES UNIV DUNDEE (GB) 2023-07-05 EP disclosed
EP-3609889-B1 SMALL MOLECULES UNIV DUNDEE (GB) 2023-07-05 EP disclosed
US-11639354-B2 Heterocyclic compound FIMECS, INC. (JP) 2023-05-02 US disclosed
US-20220402935-A1 HETEROCYCLIC COMPOUND FIMECS, INC. (JP) 2022-12-22 US disclosed
WO-2022194976-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS LES LABORATOIRES SERVIER (FR) 2022-09-22 WO disclosed
US-20220127257-A1 SMALL MOLECULES UNIVERSITY OF DUNDEE (GB) 2022-04-28 US disclosed
US-11261179-B2 Small molecules UNIVERSITY OF DUNDEE (GB) 2022-03-01 US disclosed
US-20210179614-A1 HETEROCYCLIC COMPOUND FIMECS, INC. (JP) 2021-06-17 US disclosed
EP-3831811-A1 HETEROCYCLIC COMPOUND Fimecs, Inc. (JP) 2021-06-09 EP disclosed
US-20210163469-A1 SMALL MOLECULES UNIVERSITY OF DUNDEE (GB) 2021-06-03 US disclosed
US-20210163469-A1 SMALL MOLECULES UNIVERSITY OF DUNDEE (GB) 2021-06-03 US disclosed
WO-2021020586-A1 HETEROCYCLIC COMPOUND ファイメクス株式会社 2021-02-04 WO disclosed
WO-2021020585-A1 HETEROCYCLIC COMPOUND ファイメクス株式会社 2021-02-04 WO disclosed
WO-2020027225-A1 HETEROCYCLIC COMPOUND ファイメクス株式会社 2020-02-06 WO disclosed
EP-2476678-A1 SUBSTITUTED CARBONYL COMPOUNDS Ube Industries, Ltd. (JP) 2012-07-18 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 (9 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-20230242529-A1 HETEROCYCLIC COMPOUND XIAP, BIRC5, BIRC3 TSHR 4767/4885CA1 2393/4885CA2 3598/4885
US-20240246992-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS LRRK2, PARK7, PINK1 TSHR 3780/4885CA1 4825/4885CA2 4681/4885
US-20220127257-A1 SMALL MOLECULES ADRM1, MDM2, UBE2B TSHR 3941/4885CA1 4441/4885CA2 4811/4885
US-11639354-B2 Heterocyclic compound XIAP, BIRC5, BIRC3 TSHR 4767/4885CA1 2393/4885CA2 3598/4885
US-20220402935-A1 HETEROCYCLIC COMPOUND IRAK1, IRAK2, IRAK4 TSHR 2793/4885CA1 4846/4885CA2 4392/4885
US-11261179-B2 Small molecules ADRM1, MDM2, UBE2B TSHR 3941/4885CA1 4441/4885CA2 4811/4885
US-12202829-B2 Heterocyclic compound XIAP, BIRC5, BIRC3 TSHR 4767/4885CA1 2393/4885CA2 3598/4885
US-20210179614-A1 HETEROCYCLIC COMPOUND XIAP, BIRC5, BIRC3 TSHR 4767/4885CA1 2393/4885CA2 3598/4885
US-20210163469-A1 SMALL MOLECULES ADRM1, MDM2, UBE2B TSHR 3941/4885CA1 4441/4885CA2 4811/4885

“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.