SCHEMBL8157301

SCHEMBL8157301

C=C(C)C(=O)OCCCC(=Cc1ccc(Cl)cc1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 1/20 0.44
▸ HTT P42858 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ TSHR P16473 3/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ ALOX5 P09917 2/20 0.39
▸ PTGES O14684 1/20 0.37
▸ PPARG P37231 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HDAC3 O15379 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC7 Q8WUI4 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC10 Q969S8 1/20 0.35
▸ HDAC11 Q96DB2 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35

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
SCHEMBL8380576 0.92 GRIK1 (0.46) GRIK1HTTPOLBAPEX1TDP1
SCHEMBL8153430 0.92 GRIK1 (0.46) GRIK1HTTPOLBAPEX1TDP1
SCHEMBL8151217 0.89 HTT (0.43) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8150711 0.88 MEN1 (0.44) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8151145 0.88 APEX1 (0.40) GRIK1HTTPOLBAPEX1TDP1
SCHEMBL8152443 0.87 POLB (0.40) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8156581 0.86 POLB (0.47) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8158359 0.86 POLB (0.41) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8158710 0.86 DPEP1 (0.40) GRIK1HTTPOLBAPEX1TDP1
SCHEMBL8156645 0.86 PTGS2 (0.43) HTTPOLBAPEX1TDP1TSHR

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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