SCHEMBL8152924

SCHEMBL8152924

C=C(C)C(=O)OCCC(=Cc1ccc(F)c(F)c1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.38
▸ APEX1 P27695 4/20 0.36
▸ PLA2G7 Q13093 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ ALOX5 P09917 2/20 0.34
▸ PTGES O14684 1/20 0.34
▸ PPARG P37231 1/20 0.34
▸ THRB P10828 1/20 0.33
▸ TSHR P16473 2/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ TUBB1 Q9H4B7 1/20 0.32

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
SCHEMBL8157455 0.93 APEX1 (0.40) TRPA1APEX1PLA2G7POLBHTT
SCHEMBL8151214 0.90 DPEP1 (0.41) TRPA1APEX1POLBHTTTDP1
SCHEMBL8144233 0.90 DPEP1 (0.41) TRPA1APEX1POLBHTTTDP1
SCHEMBL8157079 0.86 MEN1 (0.46) TRPA1APEX1POLBHTTTDP1
SCHEMBL8143779 0.84 MAPT (0.46) APEX1POLBHTTTDP1ALOX5
SCHEMBL8153430 0.84 GRIK1 (0.46) TRPA1APEX1POLBHTTTDP1
SCHEMBL8380576 0.84 GRIK1 (0.46) TRPA1APEX1POLBHTTTDP1
SCHEMBL8143834 0.84 APEX1 (0.36) APEX1POLBHTTTDP1ALOX5
SCHEMBL8156850 0.83 DPEP1 (0.39) APEX1POLBHTTTDP1ALOX5
SCHEMBL8153382 0.83 DPEP1 (0.40) APEX1POLBHTTTDP1ALOX5

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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