SCHEMBL7745488

SCHEMBL7745488

CCOP(=O)(OCC)c1ccc(CO[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.39
EPHX2 P34913 1/20 0.39
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
HDAC1 Q13547 1/20 0.33
CCNT1 O60563 1/20 0.32
CDK9 P50750 1/20 0.32
BACE1 P56817 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2B P41595 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
SCHEMBL7285619 0.85 HKDC1 (0.35) BACE1BTN3A1
SCHEMBL7285190 0.80 CA2 (0.34) BACE1CA2CA4CA5AMEN1
SCHEMBL906701 0.80 CA2 (0.47) POLBCA1CA2MEN1KMT2A
SCHEMBL20201343 0.79 CYP2C19 (0.37) POLBBACE1CA12CA1CA2
SCHEMBL31588025 0.79 POLB (0.63) POLBBACE1MEN1KMT2AHMGCR
SCHEMBL7745497 0.78 AGXT (0.47) LTA4HEPHX2POLBCA12CA1
SCHEMBL15489965 0.76 TDP1 (0.37) TDP1BACE1KMT2AALDH1A1
SCHEMBL6829825 0.75 TDP1 (0.49) LTA4HEPHX2POLBTDP1CCNT1
SCHEMBL11140840 0.73 POLB (0.54) LTA4HEPHX2POLBTDP1CA12
SCHEMBL22021303 0.73 MAPT (0.46) EPHX2TDP1BTN3A1ALDH1A1GAA

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-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed