SCHEMBL28935283

SCHEMBL28935283

CCCCCCCCCCC(C(=O)NO)S(=O)(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 4/20 0.55
MMP13 P45452 4/20 0.55
ADAM17 P78536 3/20 0.55
MMP1 P03956 1/20 0.55
HDAC8 Q9BY41 5/20 0.47
HDAC6 Q9UBN7 3/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
MMP8 P22894 1/20 0.44
TP53 P04637 1/20 0.43
HSP90AA1 P07900 1/20 0.41
GNAI3 P08754 1/20 0.41
GNAO1 P09471 1/20 0.41
GNAI1 P63096 1/20 0.41
GPR84 Q9NQS5 3/20 0.40
FFAR1 O14842 1/20 0.40
HDAC3 O15379 2/20 0.40

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
SCHEMBL28705417 1.00 MMP9 (0.55) MMP9MMP13ADAM17MMP1HDAC8
SCHEMBL28935319 1.00 MMP9 (0.55) MMP9MMP13ADAM17MMP1HDAC8
SCHEMBL28694225 1.00 MMP9 (0.55) MMP9MMP13ADAM17MMP1HDAC8
SCHEMBL6340106 0.93 CA1 (0.53) MMP9MMP13ADAM17MMP1HDAC8
SCHEMBL2489271 0.82 MMP1 (0.40) MMP9MMP13ADAM17MMP1CA1
SCHEMBL11486933 0.81 GNAI3 (0.41) MMP9MMP13ADAM17MMP1TP53
SCHEMBL19712174 0.81 TP53 (0.48) CA2TP53GPR84FFAR1
SCHEMBL2486962 0.80 TP53 (0.42) MMP9MMP13ADAM17MMP1TP53
SCHEMBL7609463 0.79 GPR84 (0.53) CA2TP53GPR84FFAR1HDAC1
SCHEMBL3495263 0.79 GPR84 (0.53) CA2TP53GPR84FFAR1HDAC1

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-114057614-B Hydroxamic acid sulfonic acid compound, and preparation method and application thereof 广东省科学院资源利用与稀土开发研究所 2023-05-23 CN disclosed
CN-114057614-A Hydroximic acid sulfonic acid compound and preparation method and application thereof 广东省科学院资源利用与稀土开发研究所 2022-02-18 CN disclosed