SCHEMBL28345753

SCHEMBL28345753

O=C(O)c1c(N2C(=O)C=CC2=O)cccc1N1C(=O)C=CC1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 3/20 0.58
ALDH1A1 P00352 3/20 0.58
HSP90AA1 P07900 3/20 0.58
ATM Q13315 3/20 0.58
NPSR1 Q6W5P4 2/20 0.58
PKM P14618 2/20 0.58
CCR6 P51684 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
MGLL Q99685 12/20 0.50
DDAH1 O94760 1/20 0.47
HTT P42858 2/20 0.45
MITF O75030 1/20 0.45
FAAH O00519 3/20 0.44
NSD2 O96028 1/20 0.42
G6PD P11413 1/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 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
SCHEMBL26659392 0.89 CA12 (0.55) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL10935998 0.89 TLR9 (0.56) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL7208771 0.84 TLR9 (0.46) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL183052 0.78 ALDH1A1 (0.71) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL29364136 0.78 ALDH1A1 (0.71) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL28343039 0.77 ALDH1A1 (0.56) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL26659336 0.77 ALDH1A1 (0.56) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL29566884 0.77 ALDH1A1 (0.56) TLR9ALDH1A1HSP90AA1ATMNPSR1
Hydrochloric Acid SCHEMBL6753288 0.76 ALDH1A1 (0.69) TLR9ALDH1A1HSP90AA1ATMNPSR1
SCHEMBL29377102 0.74 TLR9 (1.00) TLR9ALDH1A1HSP90AA1ATMNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110591544-B High-hardness and low-haze UV hardened layer coating liquid 四川羽玺新材料股份有限公司 2021-02-19 CN claimed
CN-110591544-A High-hardness and low-haze UV hardened layer coating liquid 四川羽玺新材料股份有限公司 2019-12-20 CN claimed
CN-110591544-B High-hardness and low-haze UV hardened layer coating liquid 四川羽玺新材料股份有限公司 2021-02-19 CN disclosed
CN-110591544-A High-hardness and low-haze UV hardened layer coating liquid 四川羽玺新材料股份有限公司 2019-12-20 CN disclosed