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SCHEMBL14560171

SCHEMBL14560171

CCOC(=O)c1cc(C(=O)Nc2ccc(-c3ccc(NC(=O)c4cc(C(c5ccc(C(=O)NC)c(C(=O)O)c5)(C(F)(F)F)C(F)(F)F)ccc4C(=O)O)cc3C(F)(F)F)c(C(F)(F)F)c2)c(C(=O)OCC)cc1C(=O)NC

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SORT1 Q99523 12/20 0.43
▸ MAPT P10636 3/20 0.38
▸ TP53 P04637 2/20 0.38
▸ S1PR1 P21453 3/20 0.37
▸ S1PR3 Q99500 2/20 0.37
▸ KCNK3 O14649 1/20 0.35
▸ KCNK9 Q9NPC2 1/20 0.35

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
SCHEMBL14560172 0.89 SORT1 (0.42) SORT1MAPTS1PR1S1PR3
SCHEMBL10024745 0.86 SORT1 (0.44) SORT1MAPTS1PR1S1PR3KCNK3
SCHEMBL14560168 0.81 CA12 (0.37) MAPTTP53S1PR1S1PR3
SCHEMBL10615535 0.77 TSHR (0.45) SORT1MAPTTP53
SCHEMBL14331409 0.77 CA12 (0.44) SORT1MAPT
SCHEMBL18965916 0.77 SORT1 (0.39) SORT1S1PR1S1PR3
SCHEMBL18965923 0.77 SORT1 (0.39) SORT1S1PR1S1PR3
SCHEMBL23595289 0.76 S1PR1 (0.44) SORT1S1PR1S1PR3
SCHEMBL19850273 0.75 SORT1 (0.38) SORT1S1PR1S1PR3
SCHEMBL19850271 0.75 SORT1 (0.38) SORT1S1PR1S1PR3

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-7189488-B2 Polyimide precursor, manufacturing method thereof, and resin composition using polyimide precursor KANEKA CORPORATION (JP) 2007-03-13 — — US disclosed
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