SCHEMBL8601948

SCHEMBL8601948

NCC(N)(C(=O)O)C(=O)CS

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.34
HIF1A Q16665 1/20 0.34
ARG1 P05089 1/20 0.34
ARG2 P78540 1/20 0.34
ODC1 P11926 2/20 0.33
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
CPB2 Q96IY4 1/20 0.30

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
SCHEMBL349825 0.80 GLRA1 (0.38) SMN1; SMN2HIF1AARG1ARG2ODC1
SCHEMBL825611 0.79 SMN1; SMN2 (0.42) SMN1; SMN2HIF1AARG1ARG2ODC1
SCHEMBL619053 0.76 TSHR (0.35) SMN1; SMN2HIF1AARG1ARG2
SCHEMBL2007928 0.76 SMN1; SMN2 (0.39) SMN1; SMN2HIF1AARG1ARG2ODC1
SCHEMBL19322605 0.74 FDPS (0.39) ARG1ARG2MAPT
SCHEMBL8991294 0.73 SMN1; SMN2 (0.32) SMN1; SMN2HIF1ABLMPMP22
SCHEMBL6890454 0.73 TSHR (0.32)
SCHEMBL5960916 0.73 FAAH (0.48)
SCHEMBL681314 0.72 SMN1; SMN2 (0.38) SMN1; SMN2HIF1AARG1ARG2ODC1
SCHEMBL19066818 0.71 FAAH (0.50)

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-0820313-A2 RADIOLABELED PEPTIDES FOR DIAGNOSIS AND THERAPY Diatide, Inc. (US) 1998-01-28 EP disclosed
EP-0804252-A2 MONOAMINE, DIAMIDE, THIOL-CONTAINING METAL CHELATING AGENTS DIATECH, INC. (US) 1997-11-05 EP disclosed
WO-1996030055-A2 RADIOLABELED PEPTIDES FOR DIAGNOSIS AND THERAPY DIATIDE, INC. (US) 1996-10-03 WO disclosed
WO-1995033497-A1 MONOAMINE, DIAMIDE, THIOL-CONTAINING METAL CHELATING AGENTS DIATECH, INC. (US) 1995-12-14 WO disclosed
US-5322929-A Tri- and tetrapeptides as ligands UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 1994-06-21 US disclosed
US-4980147-A INJECTING AS IMAGING AGENTS IN SCINTIGRAPHIC UROGRAPHY UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 1990-12-25 US disclosed
EP-0173424-A1 Radiolabeled technetium chelates for use in renal function determinations UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 1986-03-05 EP disclosed