SCHEMBL138029

SCHEMBL138029

NCCCCCCN.O=C(O)c1cc(C(=O)O)c2c(c1)C(=O)OC2=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.36
CA7 P43166 5/20 0.36
CA1 P00915 4/20 0.36
CA4 P22748 2/20 0.36
TTR P02766 5/20 0.35
CA2 P00918 2/20 0.34
CA9 Q16790 1/20 0.34
TYMS P04818 1/20 0.34
TSHR P16473 2/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 2/20 0.32
CYP3A4 P08684 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
RECQL P46063 2/20 0.32
KMT2A Q03164 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
KDM4E B2RXH2 2/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL3418940 0.88 CA12 (0.43) CA12CA7CA1CA4TTR
SCHEMBL31423810 0.88 CA12 (0.43) CA12CA7CA1CA4TTR
SCHEMBL6261348 0.80 CA12 (0.38) CA12CA7CA1CA4TTR
SCHEMBL7927900 0.77 CA12 (0.41) CA12CA7CA1CA4TTR
SCHEMBL8503573 0.75 F13A1 (0.38) CA12CA7CA1CA4TTR
SCHEMBL3747455 0.75 F13A1 (0.38) CA12CA7CA1CA4TTR
SCHEMBL7896830 0.75 F13A1 (0.38) CA12CA7CA1CA4TTR
SCHEMBL4533626 0.74 UNG (0.34) TTRPLAU
SCHEMBL8131558 0.73 TTR (0.38) CA12CA7CA1CA4TTR
SCHEMBL10778120 0.73 AKR1C4 (0.46) CA12CA7CA1CA4TTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170106123-A1 BIOERODIBLE MAGNESIUM ALLOY CONTAINING ENDOPROSTHESES BOSTON SCIENT SCIMED INC (US) 2017-04-20 US disclosed
EP-2613817-B1 BIOERODIBLE MAGNESIUM ALLOY CONTAINING ENDOPROSTHESES BOSTON SCIENT SCIMED INC (US) 2016-03-02 EP disclosed
EP-2613817-A1 BIOERODIBLE MAGNESIUM ALLOY CONTAINING ENDOPROSTHESES Boston Scientific Scimed, Inc. (US) 2013-07-17 EP disclosed
EP-2456481-A2 MEDICAL DEVICES HAVING AN INORGANIC COATING LAYER FORMED BY ATOMIC LAYER DEPOSITION Boston Scientific Scimed, Inc. (US) 2012-05-30 EP disclosed
WO-2012033637-A1 BIOERODIBLE MAGNESIUM ALLOY CONTAINING ENDOPROSTHESES BOSTON SCIENTIFIC SCIMED, INC. (US) 2012-03-15 WO disclosed
US-20120059455-A1 Bioerodible Magnesium Alloy Containing Endoprostheses BOSTON SCIENTIFIC SEIMED, INC. (US) 2012-03-08 US disclosed
EP-2320829-A1 COILS FOR VASCULAR IMPLANTS OR OTHER USES Boston Scientific Scimed, Inc. (US) 2011-05-18 EP disclosed
US-20110022160-A1 Medical Devices Having an Inorganic Coating Layer Formed by Atomic Layer Deposition BOSTON SCIENTIFIC SCIMED, INC. (US) 2011-01-27 US disclosed
WO-2011011207-A2 MEDICAL DEVICES HAVING AN INORGANIC COATING LAYER FORMED BY ATOMIC LAYER DEPOSITION BOSTON SCIENTIFIC SCIMED, INC. (US) 2011-01-27 WO disclosed
WO-2010014510-A1 COILS FOR VASCULAR IMPLANTS OR OTHER USES BOSTON SCIENTIFIC SCIMED, INC. (US) 2010-02-04 WO disclosed
US-20100030319-A1 COILS FOR VASCULAR IMPLANTS OR OTHER USES BOSTON SCIENTIFIC SCIMED, INC. (US) 2010-02-04 US disclosed