SCHEMBL7584448

SCHEMBL7584448

C=C(CCCC)C(=O)OC(=O)C(=CC=Cc1ccccc1)CCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.41
ALDH1A1 P00352 4/20 0.40
LMNA P02545 4/20 0.40
TDP1 Q9NUW8 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
GRIK1 P39086 1/20 0.40
CYP2C9 P11712 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
EGFR P00533 1/20 0.37
HDAC3 O15379 1/20 0.37
HPGD P15428 2/20 0.37
MCL1 Q07820 1/20 0.36
PTGES O14684 1/20 0.36
ALOX5 P09917 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
SCHEMBL829552 0.87 LMNA (0.40) KDM4EMEN1KMT2APOLBALDH1A1
SCHEMBL6758382 0.85 KDM4E (0.45) KDM4EMEN1KMT2APOLBALDH1A1
SCHEMBL16176644 0.82 LMNA (0.46) KDM4EMEN1KMT2APOLBALDH1A1
SCHEMBL10395475 0.82 ALDH1A1 (0.55) KDM4EMEN1KMT2APOLBALDH1A1
SCHEMBL10395474 0.82 ALDH1A1 (0.55) KDM4EMEN1KMT2APOLBALDH1A1
SCHEMBL829949 0.81 KDM4E (0.48) KDM4EMEN1KMT2APOLBALDH1A1
SCHEMBL23934240 0.80 GRIK1 (0.55) KDM4EMEN1KMT2APOLBALDH1A1
SCHEMBL375312 0.80 GRIK1 (0.55) KDM4EMEN1KMT2APOLBALDH1A1
Methacrylic Acid SCHEMBL2912337 0.80 GRIK1 (0.49) KDM4EMEN1KMT2APOLBALDH1A1
SCHEMBL11428965 0.80 KDM4E (0.51) KDM4EMEN1KMT2APOLBALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0754452-B1 Pharmaceutical preparation in form of coated capsule releasable at lower part of digestive tract TANABE SEIYAKU CO (JP) 2002-10-02 EP claimed