SCHEMBL6685860

SCHEMBL6685860

O=C1CCCCC(=O)OO1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.53
CA9 Q16790 1/20 0.53
TRIM24 O15164 2/20 0.44
TRIM33 Q9UPN9 2/20 0.44
TSHR P16473 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
CRBN Q96SW2 2/20 0.32
FKBP5 Q13451 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
SCHEMBL11311761 0.96 CA1 (0.50) CA1CA9TRIM24TRIM33TSHR
SCHEMBL8467316 0.92
SCHEMBL4518212 0.86 CA1 (0.48) CA1CA9TRIM24TRIM33TSHR
SCHEMBL22839 0.84
SCHEMBL31146633 0.83 CA1 (0.46) CA1CA9TRIM24TRIM33TSHR
SCHEMBL9765581 0.83 CA1 (0.46) CA1CA9TRIM24TRIM33TSHR
SCHEMBL15053429 0.83 CA1 (0.46) CA1CA9TRIM24TRIM33TSHR
SCHEMBL31744124 0.81 TSHR (0.65) CA1CA9TSHRALDH1A1LMNA
SCHEMBL541094 0.79 CA1 (0.41) CA1CA9TRIM24TRIM33TSHR
SCHEMBL3747926 0.78

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
CN-116745366-A Reactive radical polymer, composition, resin-coated pigment, and method for producing reactive radical polymer 日油株式会社 2023-09-12 CN disclosed
WO-2004078814-A2 FLUORINATED POLYMERS, METHODS OF PRODUCTION AND USES IN FERROELECTRIC DEVICES THEREOF HONEYWELL INTERNATIONAL INC. (US) 2004-09-16 WO disclosed