SCHEMBL29286050

SCHEMBL29286050

CN(C)CCN1C(=O)CC[C@H]1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.42
ALDH1A1 P00352 2/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
USP2 O75604 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
GFER P55789 1/20 0.35
ALOX15 P16050 1/20 0.35
P2RX7 Q99572 5/20 0.35

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
SCHEMBL8761596 0.81 P2RX7 (0.46) ACEALDH1A1KMT2AMEN1POLB
SCHEMBL8762017 0.79 MEN1 (0.57) ACEALDH1A1KMT2AMEN1POLB
SCHEMBL29833530 0.79 MEN1 (0.57) ACEALDH1A1KMT2AMEN1POLB
SCHEMBL1587390 0.78 P2RX7 (0.51) ACEKMT2AP2RX7
SCHEMBL1651090 0.78 P2RX7 (0.51) ACEKMT2AP2RX7
SCHEMBL1914212 0.78 P2RX7 (0.51) ACEKMT2AP2RX7
SCHEMBL24749823 0.77 ACE (0.42) ACEALDH1A1KMT2AMEN1POLB
SCHEMBL31694874 0.77 ACE (0.42) ACEALDH1A1CHRM2CHRM4CHRM5
SCHEMBL9152263 0.77 MEN1 (0.52) ACEALDH1A1KMT2AMEN1POLB
SCHEMBL10343416 0.77 MEN1 (0.52) ACEALDH1A1KMT2AMEN1POLB

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-118339274-A Brandy replica 艾娃食品实验室股份有限公司 2024-07-12 CN disclosed