SCHEMBL28720751

SCHEMBL28720751

C=COS(=O)(=O)c1ccccc1.[Ho]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 1/20 0.45
ALDH1A1 P00352 6/20 0.43
HTR6 P50406 1/20 0.42
TDP1 Q9NUW8 4/20 0.41
PARL Q9H300 1/20 0.41
MAPT P10636 3/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
HSD17B10 Q99714 1/20 0.39
CA12 O43570 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
PLA2G7 Q13093 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL30689644 0.98 TLR9 (0.46) TLR9ALDH1A1HTR6TDP1PARL
SCHEMBL346885 0.98 TLR9 (0.46) TLR9ALDH1A1HTR6TDP1PARL
SCHEMBL28724332 0.96 TLR9 (0.45) TLR9ALDH1A1HTR6TDP1PARL
SCHEMBL28720739 0.96 TLR9 (0.45) TLR9ALDH1A1HTR6TDP1PARL
SCHEMBL28721312 0.96 TLR9 (0.45) TLR9ALDH1A1HTR6TDP1PARL
SCHEMBL28722095 0.96 TLR9 (0.45) TLR9ALDH1A1HTR6TDP1PARL
SCHEMBL28721309 0.96 TLR9 (0.45) TLR9ALDH1A1HTR6TDP1PARL
SCHEMBL321241 0.96 TLR9 (0.45) TLR9ALDH1A1HTR6TDP1PARL
SCHEMBL11801202 0.96 TLR9 (0.45) TLR9ALDH1A1HTR6TDP1PARL
Ammonia Solution, Strong SCHEMBL28549095 0.96 TLR9 (0.45) TLR9ALDH1A1HTR6TDP1PARL

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-114316120-B Coated propping tracer containing rare earth metal elements and preparation method and application thereof 陕西科技大学 2022-12-09 CN disclosed
CN-114316120-A Coated supporting tracer containing rare earth metal elements and preparation method and application thereof 陕西科技大学 2022-04-12 CN disclosed