SCHEMBL7275349

SCHEMBL7275349

N=C(N)NCCC[C@H](NC(=O)CCCCCCCN)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 1/20 0.55
▸ NOD1 Q9Y239 6/20 0.51
▸ FOLH1 Q04609 2/20 0.48
▸ NMT2 O60551 2/20 0.46
▸ NMT1 P30419 2/20 0.46
▸ NPY4R P50391 4/20 0.45
▸ NPY1R P25929 2/20 0.45
▸ NPY2R P49146 2/20 0.45
▸ NPY5R Q15761 2/20 0.45
▸ FNTA P49354 1/20 0.45
▸ FNTB P49356 1/20 0.45
▸ GNPAT O15228 1/20 0.43

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
SCHEMBL17304351 1.00 SLC6A5 (0.55) SLC6A5NOD1FOLH1NMT2NMT1
SCHEMBL17304346 1.00 SLC6A5 (0.55) SLC6A5NOD1FOLH1NMT2NMT1
SCHEMBL12971329 1.00 SLC6A5 (0.55) SLC6A5NOD1FOLH1NMT2NMT1
SCHEMBL12971327 1.00 SLC6A5 (0.55) SLC6A5NOD1FOLH1NMT2NMT1
SCHEMBL12971402 0.99 SLC6A5 (0.53) SLC6A5NOD1FOLH1NMT2NMT1
SCHEMBL12971400 0.99 SLC6A5 (0.53) SLC6A5NOD1FOLH1NMT2NMT1
SCHEMBL17304348 0.90 NOD1 (0.52) SLC6A5NOD1FOLH1NPY4RNPY1R
SCHEMBL17304352 0.90 NOD1 (0.52) SLC6A5NOD1FOLH1NPY4RNPY1R
SCHEMBL17304354 0.90 NOD1 (0.52) SLC6A5NOD1FOLH1NPY4RNPY1R
SCHEMBL17304345 0.90 NOD1 (0.52) SLC6A5NOD1FOLH1NPY4RNPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0271041-A3 ATRIAL PEPTIDE DERIVATIVES ABBOTT LABORATORIES (US) 1990-04-11 — — EP disclosed
EP-0271041-A2 Atrial peptide derivatives ABBOTT LABORATORIES (US) 1988-06-15 — — EP disclosed
Send feedback