SCHEMBL9831355

SCHEMBL9831355

CC(C)S(=O)(=O)NCC[C@H](O)[C@@H](N)CC1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
REN P00797 4/20 0.53
METAP2 P50579 7/20 0.41
METAP1 P53582 4/20 0.37
GRIA1 P42261 3/20 0.37
CPB2 Q96IY4 1/20 0.33
BMP1 P13497 1/20 0.33

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
SCHEMBL9831358 0.82 REN (0.60) RENMETAP2METAP1
SCHEMBL7304096 0.80 REN (0.50) RENMETAP2METAP1
SCHEMBL14415383 0.79 REN (0.44) RENMETAP2METAP1CPB2
SCHEMBL14420308 0.79 REN (0.44) RENMETAP2METAP1CPB2
Hydrochloric Acid SCHEMBL7358175 0.79 REN (0.49) RENMETAP2METAP1
SCHEMBL10611293 0.76 REN (0.53) RENMETAP2METAP1CPB2
SCHEMBL7428457 0.75 REN (0.52) RENMETAP2METAP1CPB2
SCHEMBL10587950 0.75 REN (0.52) RENMETAP2METAP1CPB2
SCHEMBL7275933 0.75 REN (0.47) RENMETAP2METAP1CPB2
SCHEMBL7275926 0.75 REN (0.47) RENMETAP2METAP1CPB2

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
EP-0258289-A4 PEPTIDE ANALOGS 1991-01-02 EP disclosed
US-4857507-A HYPOTENSIVE AGENT ABBOTT LABORATORIES (US) 1989-08-15 US disclosed
EP-0258289-A1 PEPTIDE ANALOGS ABBOTT LABORATORIES (US) 1988-03-09 EP disclosed
WO-1987004349-A1 PEPTIDE ANALOGS DELLARIA JOSEPH 1987-07-30 WO disclosed