SCHEMBL5777417

SCHEMBL5777417

CC(=O)CC1CCN(c2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.50
DRD2 P14416 1/20 0.48
DRD3 P35462 1/20 0.48
AKR1C3 P42330 1/20 0.48
FFAR4 Q5NUL3 2/20 0.48
GPR119 Q8TDV5 1/20 0.47
MT-CO2 P00403 1/20 0.47
ALOX5 P09917 1/20 0.47
USP2 O75604 2/20 0.46
ADRA1D P25100 1/20 0.46
ADRA1A P35348 1/20 0.46
ADRA1B P35368 1/20 0.46
ACHE P22303 2/20 0.46
CHRM4 P08173 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MBTD1 Q05BQ5 1/20 0.45
L3MBTL3 Q96JM7 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL2557268 0.86 FFAR4 (0.61) NOTUMFFAR4ADRA1DADRA1AADRA1B
SCHEMBL25845505 0.84 GFER (0.55) AKR1C3FFAR4USP2LMNAMAPT
SCHEMBL4703338 0.83 NOTUM (0.50) NOTUMFFAR4USP2ADRA1DADRA1A
SCHEMBL22657728 0.80 ATM (0.51) NOTUMFFAR4GPR119LMNAMAPT
SCHEMBL25845507 0.79 MAPT (0.60) LMNAMAPTKMT2A
Trifluoroacetic Acid SCHEMBL1024921 0.78 FFAR4 (0.56) FFAR4CHRM4
Hydrochloric Acid SCHEMBL8332331 0.78 CKS1B (0.58) DRD2DRD3ADRA1DADRA1AADRA1B
SCHEMBL4505679 0.78 ACHE (0.63) ACHE
SCHEMBL12154736 0.78 ACHE (0.64) AKR1C3ACHEL3MBTL3L3MBTL1KMT2A
SCHEMBL12903659 0.77 NOTUM (0.64) NOTUMGPR119USP2LMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1641758-A2 DIPHENYLPYRIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION THEREOF Sanofi-Aventis (FR) 2006-04-05 EP disclosed
WO-2005000817-A2 DIPHENYLPYRIDINE DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2005-01-06 WO disclosed