SCHEMBL28878286

SCHEMBL28878286

CCOP(=O)(OCC)OCCc1ccccc1

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
NPSR1 Q6W5P4 1/20 0.46
KCNH2 Q12809 1/20 0.44
POLB P06746 1/20 0.42
ACHE P22303 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NR1I2 O75469 1/20 0.41

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
SCHEMBL2817045 0.90 CA1 (0.48) TSHRCA1CA2CA9
SCHEMBL16395450 0.89 L3MBTL1 (0.49) TSHRNPSR1
SCHEMBL26981180 0.86 CYP3A4 (0.59)
SCHEMBL26981177 0.86 CYP3A4 (0.59)
Benzene SCHEMBL27861275 0.84 CETP (0.46) TSHR
SCHEMBL18787609 0.83 CA2 (0.43) TSHRCA1CA2CA9MEN1
SCHEMBL6828915 0.83 CA2 (0.43) TSHRCA1CA2CA9MEN1
SCHEMBL11120021 0.83 TSHR (0.55) TSHRCA1CA2CA9
SCHEMBL3366798 0.82 CA1 (0.46) TSHRCA1CA2CA9
SCHEMBL7265454 0.82 NPSR1 (0.43) TSHRNPSR1KCNH2POLBACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110467795-A A kind of low viscosity liquid oxygen compatible epoxy system and preparation method thereof for wet laid fiber winding UNIV DALIAN TECH 2019-11-19 CN claimed
CN-110467795-B Low-viscosity liquid oxygen compatible epoxy resin system for wet-process fiber winding and preparation method thereof 大连理工大学 2021-02-23 CN disclosed
CN-110467795-A A kind of low viscosity liquid oxygen compatible epoxy system and preparation method thereof for wet laid fiber winding UNIV DALIAN TECH 2019-11-19 CN disclosed