SCHEMBL22167024

SCHEMBL22167024

CCC(C)C(NC)C(=O)NC(CCC(O)O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ENPEP Q07075 18/20 0.43
▸ ALDH1A1 P00352 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
SCHEMBL29539737 0.88 ENPEP (0.55) ENPEP
SCHEMBL31456232 0.83 MME (0.46) ENPEPALDH1A1
SCHEMBL17906223 0.77 ALDH1A1 (0.58) ENPEPALDH1A1
SCHEMBL17906222 0.77 ALDH1A1 (0.58) ENPEPALDH1A1
SCHEMBL30522109 0.75 GRN (0.44) ENPEPALDH1A1
SCHEMBL29381646 0.75 ENPEP (0.39) ENPEP
SCHEMBL12733456 0.75 ALDH1A1 (0.53) ENPEPALDH1A1
SCHEMBL19750997 0.74 MME (0.46) ENPEP
SCHEMBL17305533 0.73 FOLH1 (0.55) ENPEP
SCHEMBL17305534 0.72 ALDH1A1 (0.56) ENPEPALDH1A1

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
EP-3259998-B1 FLAVOR COMPOSITIONS AND METHODS FOR INCREASING SALTINESS OR UMAMI INTENSITY IN FOOD PRODUCTS USING THE SAME MARS INC (US) 2020-07-01 — — EP disclosed
Send feedback