SCHEMBL8941535

SCHEMBL8941535

O=S(=O)(c1ccc(Oc2cccc(-c3c(Oc4ccccc4)cccc3Oc3cccc(Oc4ccccc4)c3-c3cccc(Oc4ccc(S(=O)(=O)C(F)(F)C(F)(F)F)cc4)c3)c2)cc1)C(F)(F)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SDHB P21912 1/20 0.42
NR1H3 Q13133 6/20 0.41
NR1H2 P55055 5/20 0.41
SOS1 Q07889 1/20 0.38
BCL2L1 Q07817 2/20 0.38
MCL1 Q07820 2/20 0.38
NR3C1 P04150 1/20 0.38
PGR P06401 1/20 0.38
AR P10275 1/20 0.38
ESR2 Q92731 1/20 0.38
PTGS2 P35354 1/20 0.38
EPAS1 Q99814 1/20 0.38
FFAR1 O14842 2/20 0.37
FFAR4 Q5NUL3 1/20 0.37
PTPN1 P18031 1/20 0.36
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL8941547 0.87 SDHB (0.43) SDHBNR1H3NR1H2SOS1BCL2L1
SCHEMBL8941549 0.85 SOS1 (0.49) SDHBSOS1NR3C1PGRAR
SCHEMBL8941636 0.82 HTT (0.44) SOS1PTGS2EPAS1FFAR1FFAR4
SCHEMBL8941672 0.76 SOS1 (0.51) SDHBSOS1NR3C1PGRAR
SCHEMBL8941637 0.76 PTPRZ1 (0.49) SOS1EPAS1PTPN1HTTSMN1; SMN2
SCHEMBL8941500 0.73 PTPRZ1 (0.51) NR1H3NR1H2SOS1NR3C1PGR
SCHEMBL8941541 0.73 PTPRZ1 (0.51) NR1H3NR1H2SOS1NR3C1PGR
SCHEMBL8941531 0.72 PTPRZ1 (0.50) SOS1BCL2L1MCL1FFAR1FFAR4
SCHEMBL8941635 0.70 PTPN1 (0.41) SOS1PGRPTGS2EPAS1PTPN1
SCHEMBL10711910 0.69 HTT (0.62) SDHBSOS1BCL2L1MCL1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5480568-A FOR LUBRICATING METAL CONTAINING SURFACES THE DOW CHEMICAL COMPANY (US) 1996-01-02 US claimed
US-5480568-A FOR LUBRICATING METAL CONTAINING SURFACES THE DOW CHEMICAL COMPANY (US) 1996-01-02 US disclosed