SCHEMBL26817747

SCHEMBL26817747

COC(=O)[C@H](CS)NC(=O)[C@@H](C)Cc1c[nH]c2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.69
▸ ECE1 P42892 9/20 0.59
▸ MMP1 P03956 1/20 0.59
▸ MMP3 P08254 1/20 0.59
▸ MMP9 P14780 1/20 0.59
▸ MMP8 P22894 1/20 0.59
▸ MEN1 O00255 1/20 0.58
▸ HCRTR1 O43613 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ KDM4E B2RXH2 1/20 0.57
▸ APAF1 O14727 1/20 0.57
▸ POLB P06746 1/20 0.57
▸ MAPT P10636 1/20 0.57
▸ RECQL P46063 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57

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
SCHEMBL21955437 0.89 ACE (0.72) ACEECE1MMP1MMP3MMP9
SCHEMBL30053300 0.88 ACE (0.59) ACEECE1MEN1HCRTR1KMT2A
SCHEMBL11940460 0.85 KMT2A (0.70) ACEECE1MEN1HCRTR1KMT2A
SCHEMBL27257364 0.85 KMT2A (0.70) ACEECE1MEN1HCRTR1KMT2A
SCHEMBL10276380 0.83 KDM4E (0.72) ACEMEN1HCRTR1KMT2AKDM4E
SCHEMBL8258964 0.83 KDM4E (0.72) ACEMEN1HCRTR1KMT2AKDM4E
SCHEMBL30468584 0.83 CTSL (0.67) ACEMAPT
SCHEMBL28585672 0.83 CTSL (0.67) ACEMAPT
SCHEMBL28585674 0.83 CTSL (0.67) ACEMAPT
SCHEMBL7854107 0.82 KDM4E (0.70) ACEECE1MMP1MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382946-A1 POLYPEPTIDE OR PROTEIN DIRECTIONAL MODIFICATION METHOD BASED ON SULFHYDRYL-ALKENYL AZIDE COUPLING Changzhou University (CN) 2023-11-30 — — 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 (1 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-20230382946-A1 POLYPEPTIDE OR PROTEIN DIRECTIONAL MODIFICATION METHOD BASED ON SULFHYDRYL-ALKENYL AZIDE COUPLING PTMS, CBS, CHAMP1 ACE 3140/4885ECE1 3866/4885MMP1 2661/4885

“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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