Pyridine

Pyridine

SCHEMBL5081862

O=C1NC(=O)c2c(SSc3cccc4c3C(=O)NC4=O)cccc21.c1ccncc1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 2/20 0.39
▸ KDM4E B2RXH2 6/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ PARP1 P09874 5/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CASP3 P42574 5/20 0.35
▸ CASP7 P55210 2/20 0.35
▸ CASP2 P42575 1/20 0.35
▸ CASP6 P55212 1/20 0.35
▸ CASP8 Q14790 1/20 0.35
▸ MEN1 O00255 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ PTP4A3 O75365 1/20 0.33

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
SCHEMBL5074783 0.88 GSK3B (0.50) GSK3BKDM4EALDH1A1HSD17B10GAA
Pyridine SCHEMBL28186855 0.79 CA1 (0.45) GSK3BKDM4EALDH1A1HSD17B10GAA
Pyridine SCHEMBL27532836 0.79 PARP1 (0.44) GSK3BKDM4EALDH1A1HSD17B10GAA
SCHEMBL4590268 0.78 KDM4E (0.45) GSK3BKDM4EALDH1A1HSD17B10GAA
SCHEMBL30091416 0.77 GSK3B (0.50) GSK3BKDM4EALDH1A1HSD17B10GAA
SCHEMBL7078965 0.77 GSK3B (0.50) GSK3BKDM4EALDH1A1HSD17B10GAA
Phthalimide SCHEMBL1702379 0.77 GSK3B (0.68) GSK3BKDM4EALDH1A1HSD17B10GAA
Phthalimide SCHEMBL7784689 0.75 GSK3B (0.65) GSK3BKDM4EALDH1A1HSD17B10GAA
Phthalimide SCHEMBL7784687 0.75 GSK3B (0.65) GSK3BKDM4EALDH1A1HSD17B10GAA
SCHEMBL1024613 0.74 GSK3B (0.46) GSK3BKDM4EALDH1A1HSD17B10GAA

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
WO-2008103728-A1 PRECURSOR COATINGS FOR SULFUR COATED CONTROLLED RELEASE FERTILIZERS HUDSON ALICE P (US) 2008-08-28 — — WO disclosed
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