SCHEMBL9397807

SCHEMBL9397807

CC(C)(c1ccc(Oc2ccc(C(=O)O)c(C(=O)O)c2)c(F)c1)c1ccc(Oc2ccc(C(=O)O)c(C(=O)O)c2)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.44
PYGL P06737 9/20 0.43
PYGM P11217 8/20 0.43
TDP1 Q9NUW8 2/20 0.42
MEN1 O00255 1/20 0.42
TTR P02766 1/20 0.42
PPOX P50336 1/20 0.42
KMT2A Q03164 1/20 0.42
DUSP3 P51452 1/20 0.41
PTPN5 P54829 1/20 0.41
PTPN11 Q06124 1/20 0.41
HPSE Q9Y251 1/20 0.40
DHODH Q02127 1/20 0.40
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39

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
SCHEMBL28980887 0.81 POLB (0.55) POLBKDM4EALDH1A1PYGLPYGM
SCHEMBL29441323 0.81 POLB (0.55) POLBKDM4EALDH1A1PYGLPYGM
SCHEMBL260857 0.81 POLB (0.58) POLBKDM4EALDH1A1PYGLPYGM
SCHEMBL29401261 0.81 POLB (0.58) POLBKDM4EALDH1A1PYGLPYGM
SCHEMBL21437005 0.80 POLB (0.56) POLBKDM4EALDH1A1PYGLPYGM
Water SCHEMBL3777569 0.80 POLB (0.56) POLBKDM4EALDH1A1PYGLPYGM
SCHEMBL21437004 0.80 POLB (0.56) POLBKDM4EALDH1A1PYGLPYGM
SCHEMBL8628820 0.79 TDP1 (0.49) POLBKDM4EALDH1A1PYGLPYGM
SCHEMBL8906676 0.78 POLB (0.55) POLBKDM4EALDH1A1PYGLPYGM
SCHEMBL29907832 0.77 POLB (0.54) POLBKDM4EALDH1A1PYGLPYGM

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-5357033-A Forming polyetherimmides having non-symmetrical polar radicals GENERAL ELECTRIC COMPANY (US) 1994-10-18 US disclosed