SCHEMBL29468622

SCHEMBL29468622

C=Cc1cccc(OP(=O)(O)CC(F)(F)F)c1F

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.35
HTT P42858 1/20 0.33
INPPL1 O15357 1/20 0.32
INPP5B P32019 1/20 0.32
INPP5A Q14642 1/20 0.32
PTPRC P08575 1/20 0.31
PTPN2 P17706 1/20 0.31
PTPN1 P18031 1/20 0.31
PTPRB P23467 1/20 0.31
PTPN6 P29350 1/20 0.31
PTPN11 Q06124 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
SCHEMBL4124200 0.83 SRC (0.38) SRCINPPL1INPP5BINPP5A
SCHEMBL29468512 0.82 GABRA1 (0.35) HTTINPPL1INPP5BINPP5A
SCHEMBL4135658 0.79 CETP (0.40) SRC
SCHEMBL4130635 0.79 SRC (0.40) SRCINPPL1INPP5BINPP5A
SCHEMBL29468614 0.78 HTT (0.35) HTTINPPL1INPP5BINPP5APTPRC
SCHEMBL29468636 0.76 PTPN5 (0.40) HTTPTPN1
SCHEMBL16956624 0.75 ALDH1A1 (0.37) HTT
SCHEMBL29468595 0.72 PTGDR2 (0.40) SRCHTTPTPN2
SCHEMBL4124616 0.71 SRC (0.39) SRCINPPL1INPP5BINPP5A
SCHEMBL29468524 0.71 KDM4E (0.39) HTTPTPRCPTPN2PTPN1PTPRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11283107-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-22 US disclosed