SCHEMBL7436837

SCHEMBL7436837

CC(C)(C)OC(=O)N1CCC(CCC2Cc3ccc(C(=O)O)cc3C2=O)CC1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.48
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.44

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
SCHEMBL7444156 0.90 GPR119 (0.49) GPR119KDM4EPKM
SCHEMBL7444096 0.84 SMN1; SMN2 (0.48) TSHR
SCHEMBL7440251 0.83 KDM4E (0.53) GPR119KDM4EPKM
SCHEMBL7442546 0.77 KDM4E (0.45) GPR119KDM4EPKMTSHR
SCHEMBL12736015 0.74 KDM4E (0.56) GPR119KDM4EPKM
SCHEMBL1789709 0.74 ESR2 (0.60) GPR119KDM4EPKM
SCHEMBL1532734 0.73 KDM4E (0.57) GPR119KDM4EPKM
SCHEMBL1252952 0.73 KDM4E (0.57) GPR119KDM4EPKM
SCHEMBL3674207 0.73 ACHE (0.61) KDM4E
SCHEMBL7402191 0.73 GPR119 (0.55) GPR119KDM4EPKM

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-5525617-A ANTICOAGULANT MERCK & CO., INC. (US) 1996-06-11 US disclosed