SCHEMBL7159888

SCHEMBL7159888

CCCC(=O)OC(N)(C(=O)CCC)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.40
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
KDM4E B2RXH2 1/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 2/20 0.37
POLB P06746 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HPGD P15428 1/20 0.37
DRD2 P14416 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 1/20 0.36
KCNN4 O15554 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
SCHEMBL27558556 0.78 CYP2C19 (0.47) CYP2C19HIF1ACES2CES1KMT2A
SCHEMBL6036662 0.77 KDM4E (0.48) CYP1A2CYP2D6CYP2C19HIF1ACES2
SCHEMBL28754611 0.76 CYP2C19 (0.42) CYP2C19HIF1ACES2CES1KMT2A
SCHEMBL11878899 0.75 CYP2C19 (0.44) CYP2C19HIF1ACES2CES1KMT2A
SCHEMBL21436553 0.75 CYP2C19 (0.44) CYP1A2CYP2D6CYP2C19HIF1ACES2
SCHEMBL784815 0.75 CES1 (0.41) CYP1A2CYP2D6CYP2C19HIF1ACES2
SCHEMBL27870286 0.72 CES2 (0.47) CYP2C19HIF1ACES2CES1KMT2A
SCHEMBL27724083 0.72 POLB (0.47) CYP2C19HIF1ACES2CES1KMT2A
Methacrylic Acid SCHEMBL27847139 0.72 CYP2C19 (0.38) CYP2C19HIF1ACES2CES1KMT2A
SCHEMBL29008162 0.72 L3MBTL1 (0.53) CYP2C19HIF1ACES2CES1KMT2A

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
US-6558665-B1 Encapsulating particles with coatings that conform to size and shape of the particles ARCH DEVELOPMENT CORPORATION 2003-05-06 US disclosed