SCHEMBL7494386

SCHEMBL7494386

CC(C)NC1CCC(N(C)C(=O)O)CC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.35
DPP4 P27487 3/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33
DPP8 Q6V1X1 2/20 0.33
NPY5R Q15761 1/20 0.33
CYP2D6 P10635 1/20 0.32
MCHR1 Q99705 1/20 0.32
CCR2 P41597 1/20 0.32
KCNH2 Q12809 1/20 0.32
DPP9 Q86TI2 1/20 0.32
ABCC1 P33527 1/20 0.31
SMYD3 Q9H7B4 2/20 0.31
CCR5 P51681 1/20 0.31

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
SCHEMBL3833540 0.83 MEN1 (0.31) KMT2ASMN1; SMN2MEN1CYP2D6MCHR1
SCHEMBL3828381 0.83 MEN1 (0.31) KMT2ASMN1; SMN2MEN1CYP2D6MCHR1
SCHEMBL217412 0.79
SCHEMBL7498983 0.79 FASN (0.42) KMT2AMEN1NPY5RSMYD3
SCHEMBL4532414 0.79 ATM (0.34) ATMALDH1A1NPY5RABCC1
SCHEMBL967360 0.77
Hydrochloric Acid SCHEMBL4471911 0.77
SCHEMBL5270126 0.77 HSD11B1 (0.41) DPP4ALDH1A1DPP8CCR2KCNH2
SCHEMBL2621568 0.76 IRAK4 (0.35)
SCHEMBL965678 0.75 ALDH1A1 (0.50) ATMALDH1A1ABCC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1183245-A4 SELECTIVE NPY (Y5) ANTAGONISTS SYNAPTIC PHARMA CORP (US) 2002-10-02 EP disclosed
EP-1183245-A1 SELECTIVE NPY (Y5) ANTAGONISTS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2002-03-06 EP disclosed
WO-2000064880-A1 SELECTIVE NPY (Y5) ANTAGONISTS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-11-02 WO disclosed