SCHEMBL25413645

SCHEMBL25413645

N[C@@H](CCSSc1ccccn1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
EHMT2 Q96KQ7 1/20 0.44
EHMT1 Q9H9B1 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
HDAC1 Q13547 7/20 0.43
HDAC2 Q92769 7/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
SLC1A5 Q15758 2/20 0.41
KIF11 P52732 3/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL25413647 1.00 ALDH1A1 (0.47) ALDH1A1EHMT2EHMT1APOBEC3GHDAC1
SCHEMBL1498316 0.85 EHMT2 (0.47) ALDH1A1EHMT2EHMT1APOBEC3GMAPT
SCHEMBL1498318 0.85 EHMT2 (0.47) ALDH1A1EHMT2EHMT1APOBEC3GMAPT
SCHEMBL10086909 0.83 ALDH1A1 (0.47) ALDH1A1EHMT2EHMT1APOBEC3GHDAC1
Dipyridyl SCHEMBL5700787 0.81 SLC1A5 (0.44) ALDH1A1MAPTKMT2ASLC1A5KIF11
SCHEMBL19188184 0.81 HDAC1 (0.47) ALDH1A1EHMT2EHMT1APOBEC3GHDAC1
SCHEMBL4349165 0.80 ALDH1A1 (0.43) ALDH1A1EHMT2EHMT1APOBEC3GHDAC1
SCHEMBL1120030 0.80 ALDH1A1 (0.43) ALDH1A1EHMT2EHMT1APOBEC3GHDAC1
SCHEMBL31005446 0.80 ALDH1A1 (0.43) ALDH1A1EHMT2EHMT1APOBEC3GHDAC1
SCHEMBL1120092 0.80 ALDH1A1 (0.43) ALDH1A1EHMT2EHMT1APOBEC3GHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260053939-A1 Combination Therapy for Cancer GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2026-02-26 US disclosed
EP-4469484-A1 COMBINATION THERAPY FOR CANCER GlaxoSmithKline Intellectual Property Development Ltd (GB) 2024-12-04 EP disclosed
WO-2023159176-A1 COMBINATION THERAPY FOR B-CELL DISORDERS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-08-24 WO disclosed
WO-2023144702-A1 COMBINATION THERAPY FOR CANCER GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-08-03 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 (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-20260053939-A1 Combination Therapy for Cancer BCL6, PSMB6, PDCD6 ALDH1A1 4650/4885EHMT2 2009/4885EHMT1 1137/4885

“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.