SCHEMBL9597693

SCHEMBL9597693

CSCCC(N)C(=O)NC(Cc1ccccc1)C(=O)NC(CCC(=O)O)C(=O)NC(CCC(=O)O)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.56
▸ NAALAD2 Q9Y3Q0 1/20 0.56
▸ FNTA P49354 7/20 0.55
▸ FNTB P49356 7/20 0.55
▸ PGGT1B P53609 7/20 0.55
▸ BACE1 P56817 2/20 0.52

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
SCHEMBL9597700 1.00 LTA4H (0.56) LTA4HNAALAD2FNTAFNTBPGGT1B
SCHEMBL29630499 0.97 NAALAD2 (0.57) LTA4HNAALAD2FNTAFNTBPGGT1B
SCHEMBL29489259 0.94 LTA4H (0.60) LTA4HNAALAD2FNTAFNTBPGGT1B
SCHEMBL6241495 0.92 LTA4H (0.60) LTA4HNAALAD2FNTAFNTBPGGT1B
SCHEMBL8644611 0.92 FNTA (0.62) LTA4HFNTAFNTBPGGT1B
SCHEMBL8644625 0.92 FNTA (0.62) LTA4HFNTAFNTBPGGT1B
SCHEMBL29630374 0.92 BACE1 (0.62) BACE1
SCHEMBL29378966 0.91 FNTA (0.58) LTA4HFNTAFNTBPGGT1B
SCHEMBL30050929 0.90 FNTA (0.59) LTA4HFNTAFNTBPGGT1B
SCHEMBL29591515 0.90 BACE1 (0.57) BACE1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0218651-B1 A DNA SEQUENCE NOVO NORDISK A/S (DK) 1993-08-11 — — EP disclosed
EP-0218651-A1 A DNA SEQUENCE. NORDISK GENTOFTE (DK) 1987-04-22 — — EP disclosed
WO-1986005804-A1 A DNA SEQUENCE NORDISK GENTOFTE A/S (DK) 1986-10-09 — — WO disclosed
Send feedback