SCHEMBL22200274

SCHEMBL22200274

CCCC[C@@](C)(CC)O[C@@H]1C(C(=O)O)O[C@@H](OC2[C@H](O)C(CO)OC(C(C)(CCC)CCC)[C@H]2NC(N)=O)C(O)C1O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FGF1 P05230 2/20 0.38
▸ GJB2 P29033 2/20 0.35
▸ LGALS8 O00214 1/20 0.33
▸ LGALS3 P17931 1/20 0.33
▸ LGALS4 P56470 1/20 0.33
▸ MAPK1 P28482 1/20 0.31
▸ MDK P21741 2/20 0.31
▸ PTN P21246 1/20 0.31
▸ BDNF P23560 1/20 0.31
▸ FGF2 P09038 1/20 0.31
▸ VEGFA P15692 1/20 0.31
▸ HPSE Q9Y251 1/20 0.31
▸ CD209 Q9NNX6 1/20 0.30
▸ IGF2R P11717 1/20 0.30

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
SCHEMBL20122306 0.87 LGALS3 (0.39) FGF1LGALS8LGALS3LGALS4MAPK1
SCHEMBL24121225 0.86 LGALS3 (0.39) FGF1LGALS8LGALS3LGALS4MAPK1
SCHEMBL20216523 0.85 FGF1 (0.38) FGF1GJB2LGALS8LGALS3LGALS4
SCHEMBL23028969 0.85 GJB2 (0.34) FGF1GJB2LGALS8LGALS3LGALS4
SCHEMBL18737419 0.85 MDK (0.41) FGF1LGALS8LGALS3LGALS4MAPK1
SCHEMBL18883212 0.82 FGF1 (0.35) FGF1GJB2LGALS8LGALS3LGALS4
SCHEMBL20401675 0.82 FGF1 (0.33) FGF1GJB2LGALS8LGALS3LGALS4
SCHEMBL12580409 0.82 LGALS3 (0.40) FGF1LGALS8LGALS3LGALS4MAPK1
SCHEMBL23219571 0.82 FGF1 (0.35) FGF1GJB2LGALS8LGALS3LGALS4
SCHEMBL18936351 0.82 FGF1 (0.35) FGF1GJB2LGALS8LGALS3LGALS4

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
US-20200214564-A1 Mixed Ionic Electronic Conductors: Devices, Systems and Methods of Use BATTELLE MEMORIAL INSTITUTE 2020-07-09 — — US disclosed
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