SCHEMBL17899826

SCHEMBL17899826

COC1OC(CN)C(O)C(OC2OC(C(=O)O)C(C)C(O)C2O)C1NC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BDNF P23560 3/20 0.41
▸ PTN P21246 2/20 0.41
▸ MDK P21741 2/20 0.41
▸ LGALS3 P17931 7/20 0.40
▸ LGALS7; LGALS7B P47929 2/20 0.39
▸ LGALS1 P09382 1/20 0.39
▸ LGALS9 O00182 2/20 0.38
▸ F10 P00742 2/20 0.38
▸ LGALS8 O00214 2/20 0.37
▸ LGALS4 P56470 1/20 0.37
▸ MMP9 P14780 1/20 0.36
▸ MMP12 P39900 1/20 0.36
▸ CD69 Q07108 1/20 0.35
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL11965622 0.90 LGALS3 (0.49) BDNFPTNMDKLGALS3LGALS7; LGALS7B
SCHEMBL25768039 0.90 LGALS3 (0.49) BDNFPTNMDKLGALS3LGALS7; LGALS7B
SCHEMBL9885112 0.85 LGALS3 (0.39) BDNFPTNMDKLGALS3LGALS7; LGALS7B
SCHEMBL13649137 0.85 LGALS3 (0.39) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8
SCHEMBL15429218 0.84 BDNF (0.41) BDNFPTNMDKLGALS3LGALS7; LGALS7B
SCHEMBL13483313 0.82 LGALS3 (0.51) BDNFPTNMDKLGALS3LGALS7; LGALS7B
SCHEMBL27433376 0.82 LGALS3 (0.51) BDNFPTNMDKLGALS3LGALS7; LGALS7B
Dermatan SCHEMBL18232151 0.81 LGALS3 (0.49) BDNFPTNMDKLGALS3LGALS7; LGALS7B
Dermatan SCHEMBL13472480 0.81 LGALS3 (0.49) BDNFPTNMDKLGALS3LGALS7; LGALS7B
Dermatan SCHEMBL16311126 0.81 LGALS3 (0.49) BDNFPTNMDKLGALS3LGALS7; LGALS7B

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
EP-2841462-B1 CROSSLINKED HYALURONAN DERIVATIVE, METHOD OF PREPARATION THEREOF, HYDROGEL AND MICROFIBERS BASED THEREON CONTIPRO PHARMA A S (CZ) 2016-07-06 — — EP disclosed
US-9062044-B2 Disubstituted octahydropyrrolo[3,4-c]pyrroles as orexin receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2015-06-23 — — US disclosed
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