SCHEMBL29977113

SCHEMBL29977113

NC(=O)NC1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 8/20 0.57
CA1 P00915 8/20 0.57
CA2 P00918 8/20 0.57
CA9 Q16790 8/20 0.57
CA14 Q9ULX7 8/20 0.57
PYGB P11216 6/20 0.52
CD209 Q9NNX6 1/20 0.50
FGF1 P05230 1/20 0.49
FGF2 P09038 1/20 0.49
VEGFA P15692 1/20 0.49
HPSE Q9Y251 1/20 0.49
LGALS8 O00214 2/20 0.49
LGALS3 P17931 2/20 0.49
LGALS4 P56470 2/20 0.49
GAA P10253 1/20 0.49
IGF2R P11717 1/20 0.47

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
SCHEMBL30498599 1.00 CA12 (0.57) CA12CA1CA2CA9CA14
SCHEMBL14559821 0.85 FGF1 (0.56) CA12CA1CA2CA9CA14
SCHEMBL17742458 0.85 PYGB (0.72) CA12CA1CA2CA9CA14
SCHEMBL13541660 0.85 PYGB (0.53) CA12CA1CA2CA9CA14
SCHEMBL17742405 0.85 PYGB (0.72) CA12CA1CA2CA9CA14
SCHEMBL13543318 0.85 PYGB (0.53) CA12CA1CA2CA9CA14
SCHEMBL4816502 0.84 PYGB (0.65) CA12CA1CA2CA9PYGB
SCHEMBL10939188 0.84 PYGB (0.65) CA12CA1CA2CA9PYGB
SCHEMBL28491648 0.84 PYGB (0.65) CA12CA1CA2CA9PYGB
SCHEMBL8984530 0.84 CA12 (0.52) CA12CA1CA2CA9CA14

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
US-20220409919-A1 POST CECUM PHOTOTHERAPY PHOTOPILL MEDICAL LTD. (IL) 2022-12-29 US disclosed
US-11464996-B2 Capsule phototherapy PHOTOPILL MEDICAL LTD. (IL) 2022-10-11 US disclosed