SCHEMBL23857902

SCHEMBL23857902

CC(=O)SCCC(=O)Nc1cccc(C(=O)O)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 8/20 0.57
▸ SMN1; SMN2 Q16637 7/20 0.57
▸ NPC1 O15118 7/20 0.57
▸ HDAC3 O15379 1/20 0.57
▸ HDAC4 P56524 1/20 0.57
▸ HDAC1 Q13547 1/20 0.57
▸ HDAC7 Q8WUI4 1/20 0.57
▸ HDAC2 Q92769 1/20 0.57
▸ HDAC10 Q969S8 1/20 0.57
▸ HDAC11 Q96DB2 1/20 0.57
▸ HDAC8 Q9BY41 1/20 0.57
▸ HDAC6 Q9UBN7 1/20 0.57
▸ HDAC9 Q9UKV0 1/20 0.57
▸ HDAC5 Q9UQL6 1/20 0.57
▸ HTT P42858 1/20 0.55
▸ KMT2A Q03164 4/20 0.54
▸ MAPT P10636 3/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ MEN1 O00255 2/20 0.52
▸ PARP1 P09874 1/20 0.51

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
SCHEMBL6399265 0.84 HDAC4 (0.77) SMN1; SMN2NPC1HDAC3HDAC4HDAC1
SCHEMBL7432797 0.81 SMN1; SMN2 (0.51) RAB9ASMN1; SMN2NPC1HDAC3HDAC4
SCHEMBL11221078 0.81 SMN1; SMN2 (0.64) RAB9ASMN1; SMN2NPC1HTTKMT2A
SCHEMBL7444667 0.81 SMN1; SMN2 (0.62) RAB9ASMN1; SMN2NPC1HTTKMT2A
SCHEMBL2562988 0.79 SMN1; SMN2 (0.59) RAB9ASMN1; SMN2NPC1HTTKMT2A
SCHEMBL10438791 0.79 MME (0.54) RAB9ASMN1; SMN2NPC1KMT2AMAPT
SCHEMBL10438787 0.79 MME (0.54) RAB9ASMN1; SMN2NPC1KMT2AMAPT
SCHEMBL7433072 0.79 SMN1; SMN2 (0.54) RAB9ASMN1; SMN2NPC1HDAC3HDAC4
SCHEMBL5145754 0.78 KMT2A (0.62) RAB9ASMN1; SMN2NPC1HTTKMT2A
SCHEMBL7567258 0.78 SMN1; SMN2 (0.69) RAB9ASMN1; SMN2NPC1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4126833-B1 N-PHENYL-3-MERCAPTOPROPANAMIDE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS FOR THE TREATMENT OF BACTERIAL INFECTIONS HELMHOLTZ ZENTRUM INFEKTIONSFORSCHUNG GMBH (DE) 2026-05-20 — — EP disclosed
US-12616670-B2 N-phenyl-3-mercaptopropanamide derivatives as metallo-beta-lactamase inhibitors for the treatment of bacterial infections Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2026-05-05 — — US disclosed
US-20230146507-A1 N-PHENYL-3-MERCAPTOPROPANAMIDE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS FOR THE TREATMENT OF BACTERIAL INFECTIONS Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2023-05-11 — — US disclosed
EP-4126833-A1 N-PHENYL-3-MERCAPTOPROPANAMIDE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS FOR THE TREATMENT OF BACTERIAL INFECTIONS Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2023-02-08 — — EP disclosed
WO-2021191219-A1 N-PHENYL-3-MERCAPTOPROPANAMIDE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS FOR THE TREATMENT OF BACTERIAL INFECTIONS Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2021-09-30 — — 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-12616670-B2 N-phenyl-3-mercaptopropanamide derivatives as metallo-beta-lactamase inhibitors for the treatment of bacterial infections CPN1, MME, ANPEP RAB9A 2816/4885SMN1; SMN2 1495/4885NPC1 507/4885
US-20230146507-A1 N-PHENYL-3-MERCAPTOPROPANAMIDE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS FOR THE TREATMENT OF BACTERIAL INFECTIONS MGAM, PREP, MME RAB9A 1744/4885SMN1; SMN2 3392/4885NPC1 2634/4885

“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.

Send feedback