SCHEMBL8720284

SCHEMBL8720284

Cc1ccc(S(=O)(=O)OC[C@@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ TACR2 P21452 3/20 0.45
▸ NT5E P21589 1/20 0.45
▸ PTPN1 P18031 6/20 0.44
▸ PTPN2 P17706 2/20 0.44
▸ PTPN11 Q06124 2/20 0.44
▸ SSTR1 P30872 1/20 0.43
▸ SSTR2 P30874 1/20 0.43
▸ SSTR4 P31391 1/20 0.43
▸ SSTR3 P32745 1/20 0.43
▸ SSTR5 P35346 1/20 0.43
▸ FGF1 P05230 2/20 0.43
▸ FGF2 P09038 2/20 0.43
▸ VEGFA P15692 2/20 0.43
▸ HPSE Q9Y251 2/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ CDC25B P30305 4/20 0.42
▸ PTPN6 P29350 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
SCHEMBL28316892 0.90 FGF1 (0.52) CA1CA2CA9NT5EPTPN1
SCHEMBL28315418 0.89 FGF1 (0.41) CA1CA2CA9TACR2NT5E
SCHEMBL14410760 0.89 FGF1 (0.45) CA1CA2CA9TACR2NT5E
SCHEMBL14410762 0.89 FGF1 (0.45) CA1CA2CA9TACR2NT5E
SCHEMBL23705219 0.88 CA1 (0.42) CA1CA2CA9TACR2NT5E
SCHEMBL29384605 0.88 CA1 (0.42) CA1CA2CA9TACR2NT5E
SCHEMBL26879181 0.84 CA1 (0.39) CA1CA2CA9TACR2NT5E
SCHEMBL6923504 0.84 FGF1 (0.44) CA1CA2CA9NT5EPTPN1
SCHEMBL13057268 0.84 FGF1 (0.44) CA1CA2CA9NT5EPTPN1
SCHEMBL2175355 0.84 FGF1 (0.44) CA1CA2CA9NT5EPTPN1

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
EP-0832898-A2 Substituted amino acid derivatives BAYER AG (DE) 1998-04-01 — — EP disclosed
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