SCHEMBL9785114

SCHEMBL9785114

NCCCC[C@H](N)C(=O)NC(CCCCC(=O)O)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.63
▸ GSR P00390 1/20 0.51
▸ CYP2D6 P10635 1/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ BLM P54132 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ PLG P00747 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ SLC6A3 Q01959 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ SLC6A5 Q9Y345 1/20 0.47
▸ GNPAT O15228 2/20 0.46
▸ DPP8 Q6V1X1 1/20 0.46
▸ DPP9 Q86TI2 1/20 0.46

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
SCHEMBL30099610 0.94 FOLH1 (0.68) FOLH1GSRSLC6A5GNPATDPP8
SCHEMBL30099573 0.94 FOLH1 (0.68) FOLH1GSRSLC6A5GNPATDPP8
SCHEMBL29533698 0.94 FOLH1 (0.68) FOLH1GSRSLC6A5GNPATDPP8
SCHEMBL7166207 0.94 FOLH1 (0.68) FOLH1GSRSLC6A5GNPATDPP8
SCHEMBL31635788 0.94 FOLH1 (0.68) FOLH1GSRSLC6A5GNPATDPP8
SCHEMBL30099604 0.94 FOLH1 (0.68) FOLH1GSRSLC6A5GNPATDPP8
SCHEMBL30099445 0.94 FOLH1 (0.68) FOLH1GSRSLC6A5GNPATDPP8
SCHEMBL31635787 0.94 FOLH1 (0.68) FOLH1GSRSLC6A5GNPATDPP8
SCHEMBL31635789 0.94 FOLH1 (0.68) FOLH1GSRSLC6A5GNPATDPP8
SCHEMBL31635790 0.94 FOLH1 (0.68) FOLH1GSRSLC6A5GNPATDPP8

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-5030715-A Antibacterial agents; immunomodulators; auto immune diseases ROUSSEL UCLAF (FR) 1991-07-09 — — US disclosed
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