SCHEMBL8941664

SCHEMBL8941664

CS(=O)(=O)c1ccc(Oc2cccc(Oc3cccc(C(F)(F)F)c3)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.53
PGR P06401 1/20 0.53
AR P10275 1/20 0.53
ESR2 Q92731 1/20 0.53
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
MMP2 P08253 1/20 0.50
MMP3 P08254 1/20 0.50
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP13 P45452 1/20 0.50
MMP14 P50281 1/20 0.50
NR1H2 P55055 1/20 0.50
NR1H3 Q13133 1/20 0.50
KIF11 P52732 1/20 0.49
NPSR1 Q6W5P4 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL9778945 0.88 NR3C1 (0.56) NR3C1PGRARESR2KDM4E
SCHEMBL8941557 0.88 MAPT (0.56) NR3C1PGRARESR2KDM4E
SCHEMBL9778977 0.86 NR3C1 (0.57) NR3C1PGRARESR2KDM4E
SCHEMBL8855050 0.86 NR3C1 (0.57) NR3C1PGRARESR2KDM4E
SCHEMBL8941513 0.86 HTT (0.57) PGRALDH1A1NR1H2NR1H3LMNA
SCHEMBL8941546 0.85 NR3C1 (0.53) NR3C1PGRARESR2KDM4E
SCHEMBL8941548 0.84 PTGS2 (0.50) NR3C1MMP2MMP9MMP14NR1H2
SCHEMBL30702473 0.84 NR3C1 (0.54) NR3C1PGRARESR2KDM4E
SCHEMBL7990329 0.82 PTGS2 (0.57) MMP2MMP3MMP9MMP8MMP13
SCHEMBL27579381 0.82 LTA4H (0.59) NR3C1PGRARESR2ALDH1A1

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