SCHEMBL7288159

SCHEMBL7288159

CN[C@@H](CCSC)C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
RNPEP Q9H4A4 1/20 0.41
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
LMNA P02545 1/20 0.38
CA2 P00918 2/20 0.37
CA1 P00915 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KDM4E B2RXH2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL11130899 1.00 TSHR (0.41) TSHRRNPEPCA12CA9LMNA
Acetic Acid SCHEMBL11102119 0.94 RNPEP (0.41) TSHRRNPEPCA12CA9LMNA
SCHEMBL12038890 0.85 RNPEP (0.42) TSHRRNPEPLMNAMEN1KMT2A
SCHEMBL12597432 0.85 RNPEP (0.42) TSHRRNPEPLMNAMEN1KMT2A
SCHEMBL18647533 0.85 RNPEP (0.42) TSHRRNPEPLMNAMEN1KMT2A
SCHEMBL28558305 0.83 TSHR (0.41) TSHRRNPEPCA12CA9LMNA
SCHEMBL538340 0.82 TSHR (0.54) TSHRRNPEPCA12CA9LMNA
SCHEMBL538339 0.82 TSHR (0.54) TSHRRNPEPCA12CA9LMNA
SCHEMBL17928531 0.81 TSHR (0.43) TSHRRNPEPLMNAMEN1KMT2A
SCHEMBL7767616 0.81 LMNA (0.44) TSHRCA12CA9LMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0050503-B1 PHARMACOLOGICALLY ACTIVE PENTAPEPTIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1984-07-04 EP claimed
EP-0050503-A1 Pharmacologically active pentapeptide derivatives ELI LILLY AND COMPANY (US) 1982-04-28 EP claimed
US-5252560-A Cyclic imide derivatives, compositions and use GLAXO INC. (US) 1993-10-12 US disclosed
EP-0520573-A1 Cyclic imide derivatives GLAXO INC. (US) 1992-12-30 EP disclosed
EP-0050503-B1 PHARMACOLOGICALLY ACTIVE PENTAPEPTIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1984-07-04 EP disclosed
EP-0050503-A1 Pharmacologically active pentapeptide derivatives ELI LILLY AND COMPANY (US) 1982-04-28 EP disclosed
EP-0030848-A2 Pharmacologically active peptides, their preparation and pharmaceutical compositions containing them ELI LILLY AND COMPANY (US) 1981-06-24 EP disclosed