SCHEMBL7243554

SCHEMBL7243554

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

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RNPEP Q9H4A4 1/20 0.47
LMNA P02545 2/20 0.46
ALDH1A1 P00352 3/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PKM P14618 1/20 0.42
GAA P10253 1/20 0.42
FOLH1 Q04609 1/20 0.41
CA2 P00918 2/20 0.41
MAPK1 P28482 2/20 0.41
CA1 P00915 1/20 0.41
USP2 O75604 1/20 0.40
TP53 P04637 1/20 0.40
ALOX15 P16050 1/20 0.40
RAB9A P51151 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
SCHEMBL15903899 1.00 RNPEP (0.47) RNPEPLMNAALDH1A1NPSR1KDM4E
SCHEMBL30975661 0.82 RNPEP (0.52) RNPEPLMNAALDH1A1NPSR1KDM4E
SCHEMBL771623 0.82 FOLH1 (0.38) RNPEPLMNAALDH1A1KDM4EFOLH1
SCHEMBL164056 0.82 RNPEP (0.52) RNPEPLMNAALDH1A1NPSR1KDM4E
SCHEMBL748892 0.82 RNPEP (0.52) RNPEPLMNAALDH1A1NPSR1KDM4E
SCHEMBL76427 0.82 RNPEP (0.52) RNPEPLMNAALDH1A1NPSR1KDM4E
Iodide SCHEMBL3658380 0.80 RNPEP (0.50) RNPEPLMNAALDH1A1NPSR1KDM4E
Hydrogen Sulfide SCHEMBL1498068 0.80 RNPEP (0.50) RNPEPLMNAALDH1A1NPSR1KDM4E
Hydrochloric Acid SCHEMBL7204481 0.80 RNPEP (0.50) RNPEPLMNAALDH1A1NPSR1KDM4E
Hydrogen Sulfide SCHEMBL11572294 0.80 RNPEP (0.50) RNPEPLMNAALDH1A1NPSR1KDM4E

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-6541491-B1 Treating ras mediated diseases, especially cancer. ZENECA LIMITED (GB) 2003-04-01 US disclosed
US-6232338-B1 4-Mercaptopyrrolidine derivatives as farnesyl transferase inhibitors ZENECA LIMITED (GB) 2001-05-15 US disclosed
EP-0842151-A1 4-MERCAPTOPYRROLIDINE DERIVATIVES AS FARNESYL TRANSFERASE INHIBITORS ZENECA LIMITED (GB) 1998-05-20 EP disclosed
WO-1997006138-A1 4-MERCAPTOPYRROLIDINE DERIVATIVES AS FARNESYL TRANSFERASE INHIBITORS ZENECA LIMITED (GB) 1997-02-20 WO disclosed