SCHEMBL14720657

SCHEMBL14720657

CCCCCCCCCCCCCCCC[n+]1ccn(C)c1.Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.48

Known targets — ChEMBL curated mechanism

CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA

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 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HTT P42858 1/20 0.48
MEN1 O00255 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
HPGD P15428 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL28026186 1.00 KDM4E (0.48) KDM4EALDH1A1HTTMEN1CYP3A4
SCHEMBL7195917 1.00 KDM4E (0.48) KDM4EALDH1A1HTTMEN1CYP3A4
SCHEMBL28365668 1.00 KDM4E (0.48) KDM4EALDH1A1HTTMEN1CYP3A4
SCHEMBL2230706 0.95 KDM4E (0.47) KDM4EALDH1A1HTTMEN1CYP3A4
SCHEMBL7462976 0.90 ALDH1A1 (0.48) KDM4EALDH1A1HTTMEN1CYP3A4
SCHEMBL7463633 0.90 ALDH1A1 (0.48) KDM4EALDH1A1HTTMEN1CYP3A4
SCHEMBL16968739 0.87 KDM4E (0.37) KDM4EALDH1A1HTTMEN1CYP3A4
SCHEMBL16968734 0.86 KDM4E (0.37) KDM4EALDH1A1MEN1CYP3A4CYP2C9
SCHEMBL28977621 0.86 CA1 (0.42)
SCHEMBL34809 0.85 ALDH1A1 (0.40) KDM4EALDH1A1HTTMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9631101-B2 Ionic liquid release coat for use in metal flake manufacture ECKART AMERICA CORPORATION (US) 2017-04-25 US claimed
US-20140350147-A1 IONIC LIQUID RELEASE COAT FOR USE IN METAL FLAKE MANUFACTURE ECKART AMERICA CORPORATION (US) 2014-11-27 US claimed
EP-2747918-A1 IONIC LIQUID RELEASE COAT FOR USE IN METAL FLAKE MANUFACTURE Eckart America Corporation (US) 2014-07-02 EP claimed
WO-2013028970-A1 IONIC LIQUID RELEASE COAT FOR USE IN METAL FLAKE MANUFACTURE ECKART AMERICA CORPORATION (US) 2013-02-28 WO claimed
US-9631101-B2 Ionic liquid release coat for use in metal flake manufacture ECKART AMERICA CORPORATION (US) 2017-04-25 US disclosed
US-20140350147-A1 IONIC LIQUID RELEASE COAT FOR USE IN METAL FLAKE MANUFACTURE ECKART AMERICA CORPORATION (US) 2014-11-27 US disclosed
EP-2747918-A1 IONIC LIQUID RELEASE COAT FOR USE IN METAL FLAKE MANUFACTURE Eckart America Corporation (US) 2014-07-02 EP disclosed
WO-2013028970-A1 IONIC LIQUID RELEASE COAT FOR USE IN METAL FLAKE MANUFACTURE ECKART AMERICA CORPORATION (US) 2013-02-28 WO disclosed