SCHEMBL5634205

SCHEMBL5634205

CN1CCN(Cc2ccc3c(c2)CCC(N)C3)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
OPRK1 P41145 1/20 0.48
CHKA P35790 3/20 0.44
CA2 P00918 1/20 0.44
NCF1 P14598 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
MC4R P32245 1/20 0.44
KCNH2 Q12809 5/20 0.43
MCHR1 Q99705 5/20 0.43
PLAU P00749 1/20 0.42
DRD2 P14416 1/20 0.41
DRD3 P35462 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
SCHEMBL4776245 0.94 OPRK1 (0.53) OPRK1KCNH2MCHR1PLAUDRD2
SCHEMBL354877 0.89 OPRK1 (0.50) OPRK1PRMT6PLAUDRD2DRD3
SCHEMBL354878 0.89 OPRK1 (0.50) OPRK1PRMT6PLAUDRD2DRD3
SCHEMBL354963 0.87 OPRK1 (0.49) OPRK1PRMT6PLAUDRD2DRD3
SCHEMBL354962 0.87 OPRK1 (0.49) OPRK1PRMT6PLAUDRD2DRD3
SCHEMBL1725336 0.87 OPRK1 (0.49) OPRK1PRMT6PLAUDRD2DRD3
SCHEMBL5633241 0.86 OPRK1 (0.48) OPRK1KCNH2MCHR1PLAUDRD2
SCHEMBL5633787 0.85 OPRK1 (0.50) OPRK1PLAUDRD2DRD3
SCHEMBL4795153 0.85 SMN1; SMN2 (0.51) OPRK1NCF1KCNH2MCHR1PLAU
SCHEMBL4780284 0.85 OPRK1 (0.47) OPRK1PLAUDRD2DRD3

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-7304065-B2 Melanin concentrating hormone antagonists THE PROCTER & GAMBLE COMPANY (US) 2007-12-04 US claimed