SCHEMBL22390748

SCHEMBL22390748

O=C(O)N[C@@H](CCOCc1ccsc1)C(=O)CCl

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SLC1A3 P43003 2/20 0.41
▸ SLC1A2 P43004 2/20 0.41
▸ SLC1A1 P43005 2/20 0.41
▸ MME P08473 3/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CTSS P25774 1/20 0.35
▸ CTSK P43235 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.33
▸ CTSG P08311 1/20 0.33
▸ CMA1 P23946 1/20 0.33
▸ FOLH1 Q04609 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ OPRM1 P35372 1/20 0.32
▸ OPRD1 P41143 1/20 0.32
▸ OPRK1 P41145 1/20 0.32

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
SCHEMBL22390749 1.00 SLC1A3 (0.41) SLC1A3SLC1A2SLC1A1MMEMAPT
SCHEMBL22390643 0.84 SMN1; SMN2 (0.47) MMEALDH1A1CTSGCMA1FOLH1
SCHEMBL22390640 0.84 SMN1; SMN2 (0.47) MMEALDH1A1CTSGCMA1FOLH1
SCHEMBL30220129 0.84 CTSK (0.52) CTSSCTSK
SCHEMBL22390659 0.82 LMNA (0.41) FOLH1HTTSMN1; SMN2
SCHEMBL22390662 0.82 LMNA (0.41) FOLH1HTTSMN1; SMN2
SCHEMBL22390774 0.78 CTSV (0.43) CTSSCTSK
SCHEMBL22390779 0.78 CTSV (0.43) CTSSCTSK
SCHEMBL22390783 0.71 FOLH1 (0.46) MMEFOLH1HTTSMN1; SMN2
SCHEMBL22390782 0.71 FOLH1 (0.46) MMEFOLH1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230250067-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF NOBO MEDICINE INC. (KR) 2023-08-10 — — US disclosed
US-11597703-B2 Caspase inhibitors and methods of use thereof HISTOGEN, INC. (US) 2023-03-07 — — US disclosed
US-20200283396-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF NOBO MEDICINE INC. (KR) 2020-09-10 — — 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 (3 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-20230250067-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF CASP1, CASP3, CASP7 SLC1A3 4704/4885SLC1A2 4684/4885SLC1A1 4600/4885
US-20200283396-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF CASP1, CASP3, CASP7 SLC1A3 4704/4885SLC1A2 4684/4885SLC1A1 4600/4885
US-11597703-B2 Caspase inhibitors and methods of use thereof CASP1, CASP3, CASP7 SLC1A3 4704/4885SLC1A2 4684/4885SLC1A1 4600/4885

“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.

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