SCHEMBL8548648

SCHEMBL8548648

CC(C)(C)OC(=O)N1CCC(CCn2cnc(C(=O)O)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.47
GPR119 Q8TDV5 13/20 0.47
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
KDM4C Q9H3R0 1/20 0.43
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPN6 P29350 1/20 0.42

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
SCHEMBL8551343 0.89 GPR119 (0.48) FAAHGPR119KDM4EPKMPTPN2
SCHEMBL8550086 0.81 ALDH1A1 (0.42) FAAHGPR119KDM4EPKMPTPN2
SCHEMBL8549754 0.81 SMYD3 (0.45) FAAHGPR119KDM4EPKMPTPN2
SCHEMBL8623093 0.79 GPR119 (0.49) GPR119KDM4EPKMPTPN2PTPN1
SCHEMBL948286 0.74 FAAH (0.49) FAAHGPR119KDM4EPKMPTPN2
SCHEMBL23273843 0.73 P2RX7 (0.47) FAAHGPR119KDM4EPKM
SCHEMBL21316494 0.73 FAAH (0.47) FAAHGPR119KDM4EPKM
SCHEMBL1698618 0.73 GPR119 (0.56) FAAHGPR119KDM4EPKM
SCHEMBL21722971 0.73 GPR119 (0.46) FAAHGPR119KDM4EPKM
SCHEMBL948342 0.72 GPR119 (0.52) FAAHGPR119KDM4EPKM

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-0858457-A1 5-MEMBERED HETEROCYCLES, PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AND METHODS OF PRODUCING THEM Dr. Karl Thomae GmbH (DE) 1998-08-19 EP disclosed
WO-1997015567-A1 5-MEMBERED HETEROCYCLES, PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AND METHODS OF PRODUCING THEM DR. KARL THOMAE GMBH (DE) 1997-05-01 WO disclosed