SCHEMBL8990656

SCHEMBL8990656

CCCCCOc1c(F)c(F)cc(C(=O)O)c1F

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.45
THRA P10827 3/20 0.44
THRB P10828 3/20 0.44
RARB P10826 3/20 0.44
RARA P10276 2/20 0.44
PTPN11 Q06124 5/20 0.43
S1PR3 Q99500 1/20 0.43
MCL1 Q07820 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
RARG P13631 1/20 0.42

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
SCHEMBL9566681 0.98 PLA2G2A (0.48) PLA2G2ATHRATHRBRARBRARA
SCHEMBL8589991 0.95 RARB (0.48) PLA2G2ATHRATHRBRARBRARA
SCHEMBL8595728 0.91 MAPT (0.41) THRATHRBRARBRARAMCL1
SCHEMBL14699858 0.86 RARB (0.48) PLA2G2ATHRATHRBRARBRARA
SCHEMBL8593509 0.84 TSHR (0.44) THRBRARBRARATSHR
SCHEMBL9566679 0.81 THRA (0.46) THRATHRBRARB
SCHEMBL1582904 0.80 THRA (0.41) PLA2G2ATHRATHRBTP53TSHR
SCHEMBL4779552 0.80 THRA (0.41) PLA2G2ATHRATHRBTP53TSHR
SCHEMBL12256271 0.80 THRA (0.41) PLA2G2ATHRATHRBTP53TSHR
SCHEMBL1582596 0.80 THRA (0.41) PLA2G2ATHRATHRBTP53TSHR

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-5523476-A Processes for producing tetrafluorophthalic anhydride and fluorobenzoic acids ASAHI GLASS COMPANY LTD. (JP) 1996-06-04 US claimed