SCHEMBL8152013

SCHEMBL8152013

C=C(C)C(=O)OCCC(=Cc1ccc(C#N)cc1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 3/20 0.40
▸ APEX1 P27695 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ PKM P14618 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ MAPT P10636 3/20 0.37
▸ MMP2 P08253 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ DNM1 Q05193 1/20 0.34
▸ PDCD1 Q15116 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34

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
SCHEMBL8157213 0.93 POLB (0.43) FBP1APEX1POLBHTTTDP1
SCHEMBL8152091 0.88 APEX1 (0.36) APEX1POLBHTTTDP1ALOX5
SCHEMBL8150918 0.86 PDCD1 (0.51) FBP1APEX1POLBHTTTDP1
SCHEMBL8144746 0.85 DNM1 (0.37) APEX1POLBHTTTDP1ALDH1A1
SCHEMBL8157309 0.85 CA1 (0.40) APEX1POLBHTTTDP1KMT2A
SCHEMBL8152330 0.84 CYP3A4 (0.46) APEX1POLBHTTTDP1ALDH1A1
SCHEMBL9340619 0.84 CYP3A4 (0.46) APEX1POLBHTTTDP1ALDH1A1
SCHEMBL8153430 0.84 GRIK1 (0.46) APEX1POLBHTTTDP1ALDH1A1
SCHEMBL8157079 0.84 MEN1 (0.46) APEX1POLBHTTTDP1ALDH1A1
SCHEMBL8380576 0.84 GRIK1 (0.46) APEX1POLBHTTTDP1ALDH1A1

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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