SCHEMBL18095145

SCHEMBL18095145

CNC(C(=O)O)C(C)(C)S

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
MAPT P10636 1/20 0.46
PTGS1 P23219 1/20 0.46
ANPEP P15144 1/20 0.30
ENPEP Q07075 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
SCHEMBL162227 1.00 ALDH1A1 (0.46) ALDH1A1MAPTPTGS1ANPEPENPEP
SCHEMBL18095144 1.00 ALDH1A1 (0.46) ALDH1A1MAPTPTGS1ANPEPENPEP
SCHEMBL8827780 0.84 ALDH1A1 (0.35) ALDH1A1MAPTPTGS1
SCHEMBL6866649 0.80 ALDH1A1 (0.36) ALDH1A1MAPTPTGS1
SCHEMBL3458099 0.79 CA2 (0.37) ALDH1A1MAPTPTGS1
SCHEMBL3458098 0.79 CA2 (0.37) ALDH1A1MAPTPTGS1
SCHEMBL88565 0.79 CA2 (0.37) ALDH1A1MAPTPTGS1
SCHEMBL31668698 0.78 ALDH1A1 (0.44) ALDH1A1MAPTPTGS1
SCHEMBL7717432 0.78 ALDH1A1 (0.44) ALDH1A1MAPTPTGS1
SCHEMBL30125226 0.78 ALDH1A1 (0.44) ALDH1A1MAPTPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11629171-B2 Beta-hairpin peptidomimetics SPEXIS AG (CH) 2023-04-18 US disclosed
US-20210284693-A1 BETA-HAIRPIN PEPTIDOMIMETICS SPEXIS AG (CH) 2021-09-16 US disclosed
CN-113194983-A Compositions and methods for treating viral infections 奇达拉治疗公司 2021-07-30 CN disclosed
US-10829520-B2 Beta-hairpin peptidomimetics POLYPHOR AG (CH) 2020-11-10 US disclosed
CN-111770932-A Beta-hairpin peptidomimetics 波利弗尔股份公司 2020-10-13 CN disclosed
EP-3707153-A1 BETA-HAIRPIN PEPTIDOMIMETICS Polyphor Ag (CH) 2020-09-16 EP disclosed
US-20190304635-A1 NOVEL DIELECTRIC MATERIAL JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2019-10-03 US disclosed
CN-108912211-A Triazole crosslinking and thioether crosslinking peptidomimetic macrocyclic compound 爱勒让治疗公司 2018-11-30 CN disclosed
US-20180072775-A1 Beta-Hairpin Peptidomimetics POLYPHOR AG (CH) 2018-03-15 US disclosed
EP-3274361-A1 BETA-HAIRPIN PEPTIDOMIMETICS Polyphor Ag (CH) 2018-01-31 EP disclosed
CN-107636007-A Beta hairpin peptide mimics 波利弗尔股份公司 2018-01-26 CN disclosed
WO-2016150576-A1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2016-09-29 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 (5 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-20190304635-A1 NOVEL DIELECTRIC MATERIAL EPCAM, KCNN2, VDAC1 ALDH1A1 4360/4885MAPT 1921/4885PTGS1 4592/4885
US-11629171-B2 Beta-hairpin peptidomimetics POLL, POLQ, HBZ ALDH1A1 2445/4885MAPT 3326/4885PTGS1 4119/4885
US-20180072775-A1 Beta-Hairpin Peptidomimetics POLQ, POLL, POLM ALDH1A1 2557/4885MAPT 2043/4885PTGS1 3556/4885
US-20210284693-A1 BETA-HAIRPIN PEPTIDOMIMETICS POLL, POLQ, POLM ALDH1A1 2933/4885MAPT 3771/4885PTGS1 4231/4885
US-10829520-B2 Beta-hairpin peptidomimetics POLQ, POLL, POLM ALDH1A1 2557/4885MAPT 2043/4885PTGS1 3556/4885

“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.