SCHEMBL9029945

SCHEMBL9029945

Cn1ccnc1C1=Cc2cc(OCCCC(C)(C)C(=O)NC3CCCCC3)ccc2OC1CCc1ccc(F)cc1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 2/20 0.37
CNR2 P34972 10/20 0.35
CNR1 P21554 9/20 0.35
ABHD6 Q9BV23 3/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
P2RY12 Q9H244 1/20 0.33
FAAH O00519 2/20 0.33
ABHD12 Q8N2K0 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HTR2A P28223 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
SCHEMBL9029136 0.93 ALOX5 (0.35) SSTR4PDE3BPDE3AP2RY12MEN1
SCHEMBL9029711 0.89 PPARG (0.36)
SCHEMBL9030817 0.88 KDM4E (0.36) CNR2CNR1PDE3BPDE3AP2RY12
SCHEMBL9030323 0.87 HCRTR2 (0.33)
SCHEMBL9029885 0.87 PPARG (0.32)
SCHEMBL9030229 0.86 TBXAS1 (0.34)
SCHEMBL9030393 0.85 MEN1 (0.38) MEN1KMT2A
SCHEMBL4984395 0.85 EPHX2 (0.32)
SCHEMBL9029440 0.84 PPARG (0.31)
SCHEMBL9030164 0.83 ALOX5 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0513285-B1 IMIDAZOL-2-YL DERIVATIVES OF SUBSTITUTED BICYCLIC COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA SPA (IT) 1996-01-24 EP claimed
US-5356920-A Anticholesterol, antilipemic agent FARMITALIA CARLO ERBA SRL. (IT) 1994-10-18 US claimed
EP-0513285-B1 IMIDAZOL-2-YL DERIVATIVES OF SUBSTITUTED BICYCLIC COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA SPA (IT) 1996-01-24 EP disclosed
US-5356920-A Anticholesterol, antilipemic agent FARMITALIA CARLO ERBA SRL. (IT) 1994-10-18 US disclosed
WO-1992009582-A1 IMIDAZOL-2-YL DERIVATIVES OF SUBSTITUTED BICYCLIC COMPOUNDS AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA SRL (IT) 1992-06-11 WO disclosed