SCHEMBL29390797

SCHEMBL29390797

CC(=O)N[C@@H](CCCN)C(=O)O.[P]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNPAT O15228 3/20 0.54
▸ FOLH1 Q04609 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ THRB P10828 1/20 0.52
▸ ALOX15 P16050 1/20 0.52
▸ NFKB1 P19838 1/20 0.52
▸ PTGS2 P35354 1/20 0.52
▸ THPO P40225 1/20 0.52
▸ RECQL P46063 1/20 0.52
▸ BLM P54132 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.50
▸ SIRT6 Q8N6T7 1/20 0.49
▸ SIRT1 Q96EB6 1/20 0.49
▸ ITGB3 P05106 2/20 0.47
▸ ITGA2B P08514 2/20 0.47
▸ SLC6A5 Q9Y345 1/20 0.44
▸ CPB2 Q96IY4 1/20 0.41
▸ CHRM2 P08172 1/20 0.41

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
SCHEMBL159460 0.98 GNPAT (0.55) GNPATFOLH1SMN1; SMN2KDM4EMAPT
SCHEMBL159459 0.98 GNPAT (0.55) GNPATFOLH1SMN1; SMN2KDM4EMAPT
SCHEMBL159461 0.98 GNPAT (0.55) GNPATFOLH1SMN1; SMN2KDM4EMAPT
SCHEMBL31002555 0.96 GNPAT (0.54) GNPATFOLH1SMN1; SMN2KDM4EMAPT
SCHEMBL20529 0.92 FOLH1 (0.62) GNPATFOLH1SMN1; SMN2KDM4EMAPT
SCHEMBL20530 0.92 FOLH1 (0.62) GNPATFOLH1SMN1; SMN2KDM4EMAPT
SCHEMBL919220 0.92 FOLH1 (0.62) GNPATFOLH1SMN1; SMN2KDM4EMAPT
Hydrochloric Acid SCHEMBL15669796 0.91 FOLH1 (0.60) GNPATFOLH1SMN1; SMN2KDM4EMAPT
SCHEMBL16238796 0.91 FOLH1 (0.60) GNPATFOLH1SMN1; SMN2KDM4EMAPT
SCHEMBL31621379 0.91 FOLH1 (0.60) GNPATFOLH1SMN1; SMN2KDM4EMAPT

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-2022035011-A1 MICROORGANISM FOR PRODUCING PUTRESCINE AND PROCESS FOR PRODUCING PUTRESCINE BY USING SAME 씨제이제일제당 (주) 2022-02-17 — — WO disclosed
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