SCHEMBL8157455

SCHEMBL8157455

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APEX1 P27695 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ ALOX5 P09917 4/20 0.37
▸ PTGES O14684 3/20 0.37
▸ PPARG P37231 3/20 0.37
▸ TSHR P16473 2/20 0.37
▸ TRPA1 O75762 1/20 0.36
▸ DNM1 Q05193 3/20 0.34
▸ PLA2G7 Q13093 2/20 0.33
▸ THRB P10828 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL8152924 0.93 TRPA1 (0.38) APEX1POLBHTTTDP1ALOX5
SCHEMBL8153382 0.90 DPEP1 (0.40) APEX1POLBHTTTDP1ALOX5
SCHEMBL8158710 0.90 DPEP1 (0.40) APEX1POLBHTTTDP1ALOX5
SCHEMBL8150711 0.87 MEN1 (0.44) APEX1POLBHTTTDP1ALOX5
SCHEMBL8150943 0.84 POLB (0.40) APEX1POLBHTTTDP1ALOX5
SCHEMBL8157301 0.84 GRIK1 (0.44) APEX1POLBHTTTDP1ALOX5
SCHEMBL8152443 0.84 POLB (0.40) APEX1POLBHTTTDP1ALOX5
SCHEMBL8151217 0.83 HTT (0.43) APEX1POLBHTTTDP1ALOX5
SCHEMBL8144233 0.83 DPEP1 (0.41) APEX1POLBHTTTDP1ALOX5
SCHEMBL8151214 0.83 DPEP1 (0.41) 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
Send feedback