SCHEMBL30911283

SCHEMBL30911283

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

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 1/20 0.46
▸ SLC6A5 Q9Y345 1/20 0.45
▸ TERT O14746 1/20 0.43
▸ GSR P00390 1/20 0.41
▸ ERAP2 Q6P179 4/20 0.41
▸ LNPEP Q9UIQ6 4/20 0.41
▸ ERAP1 Q9NZ08 2/20 0.41
▸ NOD1 Q9Y239 3/20 0.40
▸ CPB2 Q96IY4 2/20 0.40
▸ SLC15A2 Q16348 1/20 0.40
▸ GNAI3 P08754 1/20 0.38
▸ GNAO1 P09471 1/20 0.38
▸ GNAI1 P63096 1/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ GSTK1 Q9Y2Q3 1/20 0.38

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
SCHEMBL29286382 0.91 FOLH1 (0.50) FOLH1SLC6A5TERTGSRERAP2
SCHEMBL29286384 0.91 FOLH1 (0.50) FOLH1SLC6A5TERTGSRERAP2
SCHEMBL2887196 0.89 TERT (0.52) FOLH1SLC6A5TERTGSRERAP2
SCHEMBL2887200 0.89 TERT (0.52) FOLH1SLC6A5TERTGSRERAP2
SCHEMBL30254935 0.88 FOLH1 (0.48) FOLH1SLC6A5TERTGSRERAP2
SCHEMBL30828464 0.86 FOLH1 (0.48) FOLH1SLC6A5TERTGSRERAP2
SCHEMBL29915442 0.86 TERT (0.50) FOLH1SLC6A5TERTGSRERAP2
SCHEMBL29594592 0.86 FOLH1 (0.49) FOLH1SLC6A5TERTGSRERAP2
SCHEMBL31433265 0.86 FOLH1 (0.46) FOLH1SLC6A5TERTGSRERAP2
SCHEMBL5997604 0.86 FOLH1 (0.53) FOLH1SLC6A5GSRERAP2LNPEP

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
CN-117877567-A Metabolic marker for clinical early diagnosis of smoke disease and application thereof 河南省人民医院 2024-04-12 — — CN disclosed
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