SCHEMBL17865441

SCHEMBL17865441

c1ccc(C([SiH2]OP(O[SiH2]C(c2ccccc2)c2ccccc2)O[SiH2]C(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.35
F2 P00734 1/20 0.35
TSHR P16473 1/20 0.35
HTR2A P28223 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
CYP2D6 P10635 1/20 0.31
SRC P12931 1/20 0.31
KMT2A Q03164 1/20 0.30
LMNA P02545 2/20 0.30
HRH1 P35367 1/20 0.30
MTOR P42345 1/20 0.30
RAB9A P51151 1/20 0.30
GRM7 Q14831 1/20 0.30
MAPK1 P28482 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL433140 0.77 DPP4 (0.39) DPP4F2TSHRHTR2ATAAR1
SCHEMBL587674 0.73 DPP4 (0.36) DPP4F2TSHRHTR2ATAAR1
SCHEMBL704150 0.73 KMT2A (0.40) DPP4F2TSHRHTR2ATAAR1
SCHEMBL703093 0.71 SCN4A (0.38) DPP4F2TSHRHTR2ATAAR1
SCHEMBL705271 0.70 TAAR1 (0.37) DPP4TSHRTAAR1CYP2D6KMT2A
SCHEMBL17865454 0.68 SRC (0.40) CYP2D6SRCKMT2ALMNAMAPK1
SCHEMBL242576 0.68 LMNA (0.40) HTR2ATAAR1KMT2ALMNAHRH1
SCHEMBL707823 0.68 SLC6A4 (0.37) DPP4F2TSHRHTR2ACYP2D6
SCHEMBL7029688 0.68 SRC (0.35) DPP4F2TSHRCYP2D6SRC
SCHEMBL11905375 0.68 CYP2D6 (0.38) DPP4F2TSHRCYP2D6SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3038201-B1 COMPOSITION FOR ADDITION TO ELECTROLYTE SOLUTIONS CONTAINING SILYL GROUP-CONTAINING COMPOUND, ELECTROLYTE SOLUTION FOR NONAQUEOUS ELECTRICITY STORAGE DEVICES CONTAINING SAID COMPOSITION, AND LITHIUM ION SECONDARY BATTERY CONTAINING SAID ELECTROLYTE SOLUTION ASAHI CHEMICAL IND (JP) 2019-10-30 EP disclosed
US-20160248121-A1 COMPOSITION FOR ADDITION TO ELECTROLYTE SOLUTIONS CONTAINING SILYL GROUP-CONTAINING COMPOUND, ELECTROLYTE SOLUTION FOR NONAQUEOUS ELECTRICITY STORAGE DEVICES CONTAINING SAID COMPOSITION, AND LITHIUM ION SECONDARY BATTERY CONTAINING SAID ELECTROLYTE SOLUTION ASAHI KASEI KABUSHIKI KAISHA (JP) 2016-08-25 US disclosed
EP-3038201-A1 COMPOSITION FOR ADDITION TO ELECTROLYTE SOLUTIONS CONTAINING SILYL GROUP-CONTAINING COMPOUND, ELECTROLYTE SOLUTION FOR NONAQUEOUS ELECTRICITY STORAGE DEVICES CONTAINING SAID COMPOSITION, AND LITHIUM ION SECONDARY BATTERY CONTAINING SAID ELECTROLYTE SOLUTION Asahi Kasei Kabushiki Kaisha (JP) 2016-06-29 EP disclosed