SCHEMBL31389149

SCHEMBL31389149

COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(C)c(C)c1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.65
RAB9A P51151 1/20 0.65
ALDH1A1 P00352 4/20 0.60
LMNA P02545 1/20 0.57
GLA P06280 1/20 0.57
LNPEP Q9UIQ6 1/20 0.57
TAS1R3 Q7RTX0 3/20 0.56
TAS1R1 Q7RTX1 3/20 0.56
ATM Q13315 2/20 0.55
THRB P10828 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
HSD17B10 Q99714 1/20 0.54
POLB P06746 1/20 0.53
CTSL P07711 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
TACR3 P29371 1/20 0.53
KDM4E B2RXH2 1/20 0.53
PKM P14618 1/20 0.53

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
SCHEMBL31389127 1.00 GAA (0.65) GAARAB9AALDH1A1LMNAGLA
SCHEMBL26148897 1.00 GAA (0.65) GAARAB9AALDH1A1LMNAGLA
SCHEMBL31389167 0.91 GAA (0.60) GAARAB9AALDH1A1POLBCTSL
SCHEMBL26148899 0.91 GAA (0.60) GAARAB9AALDH1A1POLBCTSL
SCHEMBL31611837 0.88 L3MBTL1 (0.64) ALDH1A1POLBL3MBTL1
SCHEMBL13525006 0.86 GAA (0.70) GAARAB9AALDH1A1LMNAGLA
SCHEMBL26820570 0.85 GAA (0.73) GAARAB9AALDH1A1LMNAGLA
SCHEMBL4175147 0.85 GAA (0.73) GAARAB9AALDH1A1LMNAGLA
SCHEMBL31206887 0.85 GAA (0.76) GAARAB9AALDH1A1LMNAGLA
SCHEMBL2461492 0.85 GAA (0.76) GAARAB9AALDH1A1LMNAGLA

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-20250024871-A1 AMIDE COMPOUNDS AND THEIR USE AS FLAVOR MODIFIERS FIRMENICH INCORPORATED (US) 2025-01-23 US disclosed