SCHEMBL11894237

SCHEMBL11894237

CCCCCCCCN(CCCCCCCC)C(N(CCCCCCCC)CCCCCCCC)=[N+](C)C.F[B-](F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.44
CA1 P00915 3/20 0.44
CA9 Q16790 3/20 0.44
CA2 P00918 2/20 0.44
MGLL Q99685 1/20 0.40
DNM1 Q05193 3/20 0.38
ZDHHC20 Q5W0Z9 2/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
GBA1 P04062 1/20 0.33
ALDH1A1 P00352 2/20 0.32
ALDH2 P05091 1/20 0.32
TSHR P16473 1/20 0.32
THRB P10828 1/20 0.32
S1PR2 O95136 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
S1PR5 Q9H228 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL11894185 1.00 CA12 (0.44) CA12CA1CA9CA2MGLL
SCHEMBL7035338 0.92 CA12 (0.41) CA12CA1CA9CA2MGLL
SCHEMBL20527532 0.92 CA12 (0.50) CA12CA1CA9CA2MGLL
SCHEMBL667939 0.92 CA12 (0.50) CA12CA1CA9CA2MGLL
Hydrochloric Acid SCHEMBL11894016 0.90 CA12 (0.48) CA12CA1CA9CA2MGLL
Hydrochloric Acid SCHEMBL11894281 0.90 CA12 (0.48) CA12CA1CA9CA2MGLL
SCHEMBL11894028 0.84 CA12 (0.47) CA12CA1CA9CA2MGLL
SCHEMBL20527595 0.83 CA12 (0.44) CA12CA1CA9CA2MGLL
SCHEMBL5878882 0.82 CA12 (0.45) CA12CA1CA9CA2MGLL
SCHEMBL7035443 0.81 CA12 (0.41) CA12CA1CA9CA2MGLL

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-3740543-A1 INCREASED SATURATION OF ICE MELTING COMPOSITIONS AND METHODS OF USE BASF SE (DE) 2020-11-25 EP claimed
US-20200339851-A1 INCREASED SATURATION OF ICE MELTING COMPOSITIONS AND METHODS OF USE BASF CORPORATION 2020-10-29 US claimed
WO-2019141568-A1 INCREASED SATURATION OF ICE MELTING COMPOSITIONS AND METHODS OF USE BASF SE (DE) 2019-07-25 WO claimed
WO-2012105958-A1 IONIC LIQUID SOLAR PONDS EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2012-08-09 WO claimed
US-20120192856-A1 IONIC LIQUID SOLAR PONDS H & C SCIENTIFIC RESOURCES INTERNATIONAL LLC 2012-08-02 US claimed
US-11584874-B2 Increased saturation of ice melting compositions and methods of use BASF SE (DE) 2023-02-21 US disclosed
EP-3740543-A1 INCREASED SATURATION OF ICE MELTING COMPOSITIONS AND METHODS OF USE BASF SE (DE) 2020-11-25 EP disclosed
US-20200339851-A1 INCREASED SATURATION OF ICE MELTING COMPOSITIONS AND METHODS OF USE BASF CORPORATION 2020-10-29 US disclosed
WO-2019141568-A1 INCREASED SATURATION OF ICE MELTING COMPOSITIONS AND METHODS OF USE BASF SE (DE) 2019-07-25 WO disclosed
WO-2012105958-A1 IONIC LIQUID SOLAR PONDS EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2012-08-09 WO disclosed
US-20120192856-A1 IONIC LIQUID SOLAR PONDS H & C SCIENTIFIC RESOURCES INTERNATIONAL LLC 2012-08-02 US disclosed