SCHEMBL2469815

SCHEMBL2469815

CCCCCCCCCCCCCCCCCC[N+](C)(CCO)CCC[N+](C)(CCO)CCO.COS(=O)(=O)[O-].COS(=O)(=O)[O-]

nearest known ligand 0.46

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.46
PSMD14 O00487 2/20 0.44
PLA2G1B P04054 2/20 0.44
MMP2 P08253 2/20 0.44
ATG4B Q9Y4P1 2/20 0.44
RAD52 P43351 1/20 0.44
RECQL P46063 2/20 0.40
GLA P06280 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
EPHX2 P34913 1/20 0.40
BLM P54132 1/20 0.40
HSP90AA1 P07900 1/20 0.37
LSS P48449 1/20 0.37
HTT P42858 1/20 0.35

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
SCHEMBL6672668 0.98 DNM1 (0.47) DNM1PSMD14PLA2G1BMMP2ATG4B
SCHEMBL11292693 0.98 DNM1 (0.47) DNM1PSMD14PLA2G1BMMP2ATG4B
SCHEMBL2026336 0.98 DNM1 (0.47) DNM1PSMD14PLA2G1BMMP2ATG4B
SCHEMBL6668543 0.98 DNM1 (0.47) DNM1PSMD14PLA2G1BMMP2ATG4B
SCHEMBL6669104 0.98 DNM1 (0.47) DNM1PSMD14PLA2G1BMMP2ATG4B
SCHEMBL28311626 0.92 DNM1 (0.44) DNM1PSMD14PLA2G1BMMP2ATG4B
SCHEMBL29281610 0.92 DNM1 (0.44) DNM1PSMD14PLA2G1BMMP2ATG4B
SCHEMBL30954840 0.92 DNM1 (0.44) DNM1PSMD14PLA2G1BMMP2ATG4B
SCHEMBL15140667 0.92 DNM1 (0.43) DNM1PSMD14PLA2G1BMMP2ATG4B
SCHEMBL27870214 0.90 DNM1 (0.42) DNM1PSMD14PLA2G1BMMP2ATG4B

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
EP-1805037-B1 DONOR ELEMENT WITH RELEASE-MODIFIER FOR THERMAL TRANSFER DU PONT (US) 2011-10-05 EP disclosed
EP-1805034-B1 DONOR ELEMENT FOR THERMAL TRANSFER DU PONT (US) 2010-12-01 EP disclosed
EP-1802471-B1 DONOR ELEMENT FOR RADIATION-INDUCED THERMAL TRANSFER DU PONT (US) 2010-12-01 EP disclosed
US-7763411-B2 support layer, light-to-heat conversion layer comprising light absorber, transfer layer, and release modifier such as quaternery ammonium compound E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-27 US disclosed
US-20090047596-A1 Donor element with release-modifier for thermal transfer E. I. DU PONT DE NEMOURS AND COMPANY 2009-02-19 US disclosed
US-20090047597-A1 Donor element for radiation-induced thermal transfer E. I. DU PONT DE NEMOURS AND COMPANY 2009-02-19 US disclosed
US-7387864-B2 Donor element for thermal transfer E.I. DU PONT DE NEMOURS AND COMPANY (US) 2008-06-17 US disclosed
US-20080090169-A1 Composite Film Suitable as a Donor Support in a Radiation-Induced Thermal Transfer Imaging Process DUPONT TEIJIN FILMS U.S. LIMITED PARTNERSHIP (DE) 2008-04-17 US disclosed
US-20080003519-A1 Donor Element for Thermal Transfer E. I. DU PONT DE NEMOURS AND COMPANY 2008-01-03 US disclosed
EP-1805034-A1 DONOR ELEMENT FOR THERMAL TRANSFER E.I. DUPONT DE NEMOURS AND COMPANY (US) 2007-07-11 EP disclosed
WO-2006045085-A1 DONOR ELEMENT FOR THERMAL TRANSFER E.I. DUPONT DE NEMOURS AND COMPANY (US) 2006-04-27 WO disclosed