SCHEMBL29220488

SCHEMBL29220488

CCc1nn(C)c(S(N)(=O)=O)c1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
CA1 P00915 15/20 0.35
CA2 P00918 15/20 0.35
CA9 Q16790 5/20 0.32
CA12 O43570 2/20 0.32
CA4 P22748 2/20 0.32
CA6 P23280 2/20 0.32
CA5A P35218 2/20 0.32
CA7 P43166 2/20 0.32
CA14 Q9ULX7 2/20 0.32
CA5B Q9Y2D0 2/20 0.32
CA3 P07451 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
CA13 Q8N1Q1 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 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
SCHEMBL10574711 0.78 KDM4E (0.42) GAACA1CA2CA9CA12
SCHEMBL1496038 0.76 GAA (0.52) GAAGABRPGABRDGABRA1GABRB1
SCHEMBL9199894 0.74 GAA (0.36) GAAGABRPGABRDGABRA1GABRB1
SCHEMBL8304267 0.73 L3MBTL1 (0.44) GAAMAPTCYP2C9
SCHEMBL8464235 0.69 SMN1; SMN2 (0.33)
SCHEMBL10578960 0.69 PDE4D (0.44) GAACA1CA2CA9CA12
SCHEMBL20551504 0.68 GABRP (0.33) GAAGABRPGABRDGABRA1GABRB1
SCHEMBL10743962 0.67 MAPT (0.39) GAACA1CA2CA9CA12
SCHEMBL10720592 0.66 GABRP (0.39) CA1CA2CA9CA12MAPT
SCHEMBL15825839 0.66 GAA (0.43) GAAMAPTHPGDHSD17B10GABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115386158-B Weather-resistant mulching film 甘肃济洋塑料有限公司 2023-07-25 CN disclosed