SCHEMBL8152937

SCHEMBL8152937

C=C(C)C(=O)OCCC(=Cc1ccc(C(F)(F)F)cc1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 7/20 0.39
▸ ALOX5 P09917 5/20 0.39
▸ PTGES O14684 3/20 0.39
▸ PPARG P37231 3/20 0.39
▸ PSEN2 P49810 1/20 0.39
▸ APH1B Q8WW43 1/20 0.39
▸ NCSTN Q92542 1/20 0.39
▸ APH1A Q96BI3 1/20 0.39
▸ PSENEN Q9NZ42 1/20 0.39
▸ AKR1C3 P42330 1/20 0.39
▸ DPEP1 P16444 1/20 0.39
▸ PPARA Q07869 1/20 0.38
▸ PTGS2 P35354 2/20 0.37
▸ PTGS1 P23219 2/20 0.37
▸ NQO2 P16083 1/20 0.37
▸ EPHX2 P34913 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ TDP1 Q9NUW8 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
SCHEMBL8153415 0.93 ALOX5 (0.42) PSEN1ALOX5PTGESPPARGPSEN2
SCHEMBL8157079 0.86 MEN1 (0.46) ALOX5PTGESPPARGAKR1C3DPEP1
SCHEMBL8152711 0.86 POLB (0.40) ALOX5PTGESPPARGEPHX2POLB
SCHEMBL8157309 0.85 CA1 (0.40) ALOX5AKR1C3POLBAPEX1HTT
SCHEMBL8152330 0.84 CYP3A4 (0.46) ALOX5PTGESPPARGAKR1C3POLB
SCHEMBL9340619 0.84 CYP3A4 (0.46) ALOX5PTGESPPARGAKR1C3POLB
SCHEMBL8153430 0.84 GRIK1 (0.46) ALOX5AKR1C3PPARAPOLBAPEX1
SCHEMBL8380576 0.84 GRIK1 (0.46) ALOX5AKR1C3PPARAPOLBAPEX1
SCHEMBL8144639 0.82 TBXAS1 (0.40) ALOX5PTGESPPARGAKR1C3POLB
SCHEMBL8157085 0.82 TDP1 (0.43) ALOX5AKR1C3POLBAPEX1HTT

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-RE36625-E Linear and cyclic polymers or oligomers having a photoreactive ethene group ROLIC AG (CH) 2000-03-21 — — US disclosed
US-5539074-A LIQUID CRYSTAL POLYMERS ON SILICA FOR LIGHT SENSITIVE ELEMENTS HOFFMANN-LA ROCHE INC. (US) 1996-07-23 — — US disclosed
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