SCHEMBL5857636

SCHEMBL5857636

CC(NC1(CN)CCCCC1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.42
LTA4H P09960 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
TSHR P16473 1/20 0.39
BLM P54132 1/20 0.39
CACNA2D1 P54289 1/20 0.39
RAB9A P51151 1/20 0.32
GABRR1 P24046 2/20 0.31

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
SCHEMBL515527 0.84 MME (0.44) MMELTA4HSMN1; SMN2RAB9A
SCHEMBL3725757 0.84 MME (0.44) MMELTA4HSMN1; SMN2RAB9A
SCHEMBL14742983 0.81 MME (0.45) MMELTA4HSMN1; SMN2ALDH1A1RAB9A
SCHEMBL23029293 0.78 USP2 (0.30) SMN1; SMN2USP2ALDH1A1LMNACYP1A2
SCHEMBL21235180 0.78 USP2 (0.30) SMN1; SMN2USP2ALDH1A1LMNACYP1A2
SCHEMBL23029153 0.78 USP2 (0.30) SMN1; SMN2USP2ALDH1A1LMNACYP1A2
SCHEMBL24230004 0.78 USP2 (0.30) SMN1; SMN2USP2ALDH1A1LMNACYP1A2
SCHEMBL24230134 0.76
SCHEMBL28871675 0.76 MME (0.41) MMELTA4HSMN1; SMN2USP2ALDH1A1
SCHEMBL997755 0.76 MME (0.42) MMELTA4HSMN1; SMN2USP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7015306-B2 Labeled neurotensin derivatives BIOSYNTHEMA, INC. (US) 2006-03-21 US claimed
US-20050191240-A1 Peptide analogs of neurotensin resistant to enzymatic degradation and retain high binding affinity for neurotensin receptors; metal chelating group on one end; replacing Arg8 with Gly(PipAm) ((N-amidinopiperidinyl)glycine) for example; useful for diagnostic and therapeutic purposes ADVANCED ACCELERATOR APPLICATIONS USA, INC. 2005-09-01 US claimed
EP-1194444-A2 LABELED NEUROTENSIN DERIVATIVES WITH IMPROVED RESISTANCE TO ENZYMATIC DEGRADATION BioSynthema Inc. (US) 2002-04-10 EP claimed
WO-2000078796-A2 LABELED NEUROTENSIN DERIVATIVES WITH IMPROVED RESISTANCE TO ENZYMATIC DEGRADATION MALLINCKRODT INC. (US) 2000-12-28 WO claimed
US-20250270255-A1 CASPASE-2 INHIBITOR COMPOUNDS KINTSUGI THERAPEUTICS S L (ES) 2025-08-28 US disclosed
EP-4363436-A1 CASPASE-2 INHIBITOR COMPOUNDS Kintsugi Therapeutics S.L. (ES) 2024-05-08 EP disclosed
CN-117940444-A Caspase-2 inhibitor compounds 金特速吉医疗有限责任公司 2024-04-26 CN disclosed
WO-2023275357-A1 CASPASE-2 INHIBITOR COMPOUNDS Kintsugi Therapeutics S.L. (ES) 2023-01-05 WO disclosed
EP-4112631-A1 CASPASE-2 INHIBITOR COMPOUNDS Kintsugi Therapeutics S.L. (ES) 2023-01-04 EP disclosed
US-11302421-B2 Data storage using peptides THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2022-04-12 US disclosed
US-20210090688-A1 Data storage using peptides THE HONG KONG POLYTECHNIC UNIVERSITY (CN) 2021-03-25 US disclosed
US-7015306-B2 Labeled neurotensin derivatives BIOSYNTHEMA, INC. (US) 2006-03-21 US disclosed
US-20050191240-A1 Peptide analogs of neurotensin resistant to enzymatic degradation and retain high binding affinity for neurotensin receptors; metal chelating group on one end; replacing Arg8 with Gly(PipAm) ((N-amidinopiperidinyl)glycine) for example; useful for diagnostic and therapeutic purposes ADVANCED ACCELERATOR APPLICATIONS USA, INC. 2005-09-01 US disclosed
EP-1194444-A2 LABELED NEUROTENSIN DERIVATIVES WITH IMPROVED RESISTANCE TO ENZYMATIC DEGRADATION BioSynthema Inc. (US) 2002-04-10 EP disclosed
WO-2000078796-A2 LABELED NEUROTENSIN DERIVATIVES WITH IMPROVED RESISTANCE TO ENZYMATIC DEGRADATION MALLINCKRODT INC. (US) 2000-12-28 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-20250270255-A1 CASPASE-2 INHIBITOR COMPOUNDS CASP2, CASP1, CASP3 MME 947/4885LTA4H 1981/4885SMN1; SMN2 605/4885
US-20050191240-A1 Peptide analogs of neurotensin resistant to enzymatic degradation and retain high binding affinity for neurotensin receptors; metal chelating group on one end; replacing Arg8 with Gly(PipAm) ((N-amidinopiperidinyl)glycine) for example; useful for diagnostic and therapeutic purposes ANPEP, DNPEP, NTSR1 MME 36/4885LTA4H 2664/4885SMN1; SMN2 1507/4885

“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.