SCHEMBL4314482

SCHEMBL4314482

CCNC(C=O)Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.56
ACE P12821 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
EPHX1 P07099 1/20 0.47
CAPN1 P07384 2/20 0.47
CTSB P07858 5/20 0.46
CTSK P43235 5/20 0.46
CTSL P07711 3/20 0.46
CTSH P09668 2/20 0.46

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
SCHEMBL12468722 1.00 SIGMAR1 (0.56) SIGMAR1ACEMEN1KMT2ATAAR1
SCHEMBL21654011 0.84 CAPN1 (0.49) SIGMAR1ACEMEN1KMT2ATAAR1
SCHEMBL24288430 0.83 SIGMAR1 (0.53) SIGMAR1ACEMEN1KMT2ATAAR1
SCHEMBL5028604 0.83 SIGMAR1 (0.53) SIGMAR1ACEMEN1KMT2ATAAR1
SCHEMBL9726218 0.82 SIGMAR1 (0.50) SIGMAR1CTSBCTSKCTSLCTSH
SCHEMBL16944013 0.81 ACE (0.49) ACEMEN1KMT2ATAAR1EPHX1
SCHEMBL18494852 0.81 ACE (0.49) ACEMEN1KMT2ATAAR1EPHX1
SCHEMBL13259262 0.81 ACE (0.50) ACECAPN1CTSBCTSKCTSL
SCHEMBL2920753 0.81 TAAR1 (0.53) SIGMAR1ACEMEN1KMT2ATAAR1
SCHEMBL6852338 0.81 TAAR1 (0.53) SIGMAR1ACEMEN1KMT2ATAAR1

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
US-11573224-B2 Methods of detection using X-ray fluorescence ICAGEN, LLC (US) 2023-02-07 US disclosed
US-20210254056-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION 2021-08-19 US disclosed
US-10877035-B2 Advanced drug development and manufacturing ICAGEN, LLC (US) 2020-12-29 US disclosed
US-20200278346-A1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ADJACENT ACQUISITION CO., LLC 2020-09-03 US disclosed
WO-2018204764-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION (US) 2018-11-08 WO disclosed
US-20150309021-A1 Advanced Drug Development and Manufacturing LOS ALAMOS NATIONAL SECURITY, LLC 2015-10-29 US disclosed
EP-2511844-B1 X-ray microscope XRPRO SCIENCES INC (US) 2015-08-12 EP disclosed
EP-2511844-A2 Advanced drug development and manufacturing Los Alamos National Security, LLC (US) 2012-10-17 EP disclosed
EP-2084519-B1 X-RAY FLUORESCENCE ANALYSIS METHOD LOS ALAMOS NAT SECURITY LLC (US) 2012-08-01 EP disclosed
EP-2084519-A2 ADVANCED DRUG DEVELOPMENT AND MANUFACTURING Los Alamos National Security, LLC (US) 2009-08-05 EP disclosed
WO-2008127291-A2 ADVANCED DRUG DEVELOPMENT AND MANUFACTURING LOS ALAMOS NATIONAL SECURITY, LLC (US) 2008-10-23 WO disclosed
US-20080220441-A1 Advanced drug development and manufacturing THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-09-11 US disclosed
EP-1351982-B1 X RAY CRYSTAL STRUCTURES AT 5.5 A RESOLUTION OF FUNCTIONAL COMPLEXES OF THE BACTERIAL RIBOSOME CONTAINING TRANSFER RNA AND MODEL MESSENGER RNAS UNIV CALIFORNIA (US) 2008-02-13 EP disclosed