SCHEMBL3628918

SCHEMBL3628918

O=C(CC(S)S)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 1/20 0.38
FAAH O00519 8/20 0.36
CES1 P23141 7/20 0.34
CES2 O00748 4/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PLOD2 O00469 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
Trifluoroacetic Acid SCHEMBL894768 0.93 CPA1 (0.43) CPA1FAAHCES1CES2MEN1
SCHEMBL20995341 0.79 FAAH (0.38) CPA1FAAHCES1CES2MEN1
SCHEMBL1492542 0.72 ALDH1A1 (0.46) CPA1FAAHCES1CES2MEN1
SCHEMBL23326065 0.70 CETP (0.42) CPA1FAAHCES1CES2MEN1
SCHEMBL27044758 0.70 FAAH (0.39) CPA1FAAHCES1CES2MEN1
SCHEMBL19501033 0.69 FAAH (0.38) CPA1FAAHCES1CES2MEN1
SCHEMBL13864005 0.69 FAAH (0.38) CPA1FAAHCES1CES2MEN1
SCHEMBL19501022 0.69 FAAH (0.38) CPA1FAAHCES1CES2MEN1
SCHEMBL30358256 0.69 FAAH (0.38) CPA1FAAHCES1CES2MEN1
SCHEMBL28700671 0.69 CPA1 (0.36) CPA1FAAHCES1CES2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021040022-A1 CELL-PENETRATING PEPTIDE AND USE THEREOF 公立大学法人大阪 2021-03-04 WO disclosed
US-20150246145-A1 Labelled adrenomedullin derivatives and their use for imaging and therapy. PULMOSCIENCE INC (CA) 2015-09-03 US disclosed
US-9062123-B2 Labelled adrenomedullin derivatives and their use for imaging and therapy PLUMOSCIENCE INC. (CA) 2015-06-23 US disclosed
US-8703098-B2 Labelled adrenomedullin derivatives and their use for imaging and therapy INSTITUT DE CARDIOLOGIE DE MONTREAL (CA) 2014-04-22 US disclosed
US-8475764-B2 Labelled adrenomedullin derivatives and their use for imaging and therapy INSTITUT DE CARDIOLOGIE DE MONTREAL (CA) 2013-07-02 US disclosed
EP-2155781-B1 LABELLED ADRENOMEDULLIN DERIVATIVES AND THEIR USE FOR IMAGING AND THERAPY. INST CARDIOLOGIE MONTREAL (CA) 2013-03-13 EP disclosed
EP-2155781-A1 LABELLED ADRENOMEDULLIN DERIVATIVES AND THEIR USE FOR IMAGING AND THERAPY. Institut de Cardiologie de Montréal (CA) 2010-02-24 EP disclosed
US-20090028790-A1 Labelled adrenomedullin derivatives and their use for imaging and therapy PULMOSCIENCE INC. (CA) 2009-01-29 US disclosed
WO-2008138141-A1 LABELLED ADRENOMEDULLIN DERIVATIVES AND THEIR USE FOR IMAGING AND THERAPY. INSTITUT DE CARDIOLOGIE DE MONTRÉAL (CA) 2008-11-20 WO disclosed
US-20080274050-A1 Labelled Adrenomedullin Derivatives and Their Use for Imaging and Therapy INSTITUT DE CARDIOLOGIE DE MONTRÉAL (CA) 2008-11-06 US disclosed
EP-1749026-A4 LABELLED ADRENOMEDULLIN DERIVATIVES AND THEIR USE FOR IMAGING AND THERAPY INST CARDIOLOGIE MONTREAL (CA) 2008-10-29 EP disclosed
EP-1749026-A1 LABELLED ADRENOMEDULLIN DERIVATIVES AND THEIR USE FOR IMAGING AND THERAPY Institut de Cardiologie de Montréal (CA) 2007-02-07 EP disclosed
WO-2005116065-A1 LABELLED ADRENOMEDULLIN DERIVATIVES AND THEIR USE FOR IMAGING AND THERAPY INSTITUT DE CARDIOLOGIE DE MONTRÉAL (CA) 2005-12-08 WO disclosed