SCHEMBL8144690

SCHEMBL8144690

C=C(C)C(=O)OCCCC(=Cc1ccc(C)cc1C)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ TSHR P16473 3/20 0.39
▸ ALOX5 P09917 6/20 0.35
▸ PTGES O14684 5/20 0.35
▸ PPARG P37231 3/20 0.35
▸ HPGD P15428 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ THRB P10828 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
SCHEMBL8157089 0.93 APEX1 (0.36) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8151217 0.83 HTT (0.43) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8152729 0.79 POLB (0.43) HTTPOLBAPEX1TDP1ALOX5
SCHEMBL8150966 0.79 POLB (0.38) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8157433 0.77 APEX1 (0.39) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8158569 0.76 TDP1 (0.43) HTTPOLBAPEX1TDP1ALDH1A1
SCHEMBL8144687 0.76 ESR1 (0.41) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8552120 0.76 RAB9A (0.35) HTTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL8157309 0.75 CA1 (0.40) HTTPOLBAPEX1TDP1TSHR
SCHEMBL8151145 0.75 APEX1 (0.40) 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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