SCHEMBL8156926

SCHEMBL8156926

C=C(C)C(=O)OCCC(=Cc1ccc([N+](=O)[O-])cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ FBP1 P09467 1/20 0.39
▸ MAPT P10636 5/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ LMNA P02545 3/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ PTGS2 P35354 2/20 0.37
▸ BRAF P15056 1/20 0.37
▸ GLO1 Q04760 1/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ HTT P42858 2/20 0.36
▸ BCL9 O00512 1/20 0.36
▸ CTNNB1 P35222 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ APEX1 P27695 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
SCHEMBL8158364 0.93 TDP1 (0.39) MEN1KMT2AFBP1MAPTKDM4E
SCHEMBL8150606 0.86 GLO1 (0.54) MEN1KMT2AFBP1MAPTKDM4E
SCHEMBL8157309 0.84 CA1 (0.40) MEN1KMT2AMAPTLMNANPC1
SCHEMBL9340619 0.83 CYP3A4 (0.46) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL8152330 0.83 CYP3A4 (0.46) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL8157290 0.83 MAPT (0.41) KMT2AMAPTKDM4ESMN1; SMN2LMNA
SCHEMBL8153430 0.83 GRIK1 (0.46) ALDH1A1HTTPOLBAPEX1TDP1
SCHEMBL8380576 0.83 GRIK1 (0.46) ALDH1A1HTTPOLBAPEX1TDP1
SCHEMBL8157079 0.83 MEN1 (0.46) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL8152002 0.82 MAPT (0.42) MEN1KMT2AMAPTKDM4ESMN1; SMN2

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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