SCHEMBL5332291

SCHEMBL5332291

O=C(O)N1CC2C(COc3cccc(Cl)c3)C2C1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.48
FKBP1A P62942 1/20 0.47
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45
RXRG P48443 1/20 0.45
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
HRH3 Q9Y5N1 7/20 0.44
ENPP2 Q13822 2/20 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
SCHEMBL5324970 0.83 STS (0.47) GRM2FKBP1ATP53HRH3
SCHEMBL5324977 0.83 STS (0.47) GRM2FKBP1ATP53HRH3
SCHEMBL5324981 0.83 STS (0.47) GRM2FKBP1ATP53HRH3
SCHEMBL5322226 0.75 TAAR1 (0.47) GRM2KDM4EALDH1A1HRH3
SCHEMBL5322223 0.75 TAAR1 (0.47) GRM2KDM4EALDH1A1HRH3
SCHEMBL5322220 0.75 TAAR1 (0.47) GRM2KDM4EALDH1A1HRH3
SCHEMBL27158547 0.73 HDAC4 (0.37)
SCHEMBL6274777 0.73 GRM2 (0.45) GRM2FKBP1ARXRARXRBRXRG
SCHEMBL27158544 0.73 HDAC4 (0.37)
SCHEMBL23149400 0.72 MGLL (0.47)

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
WO-2007135529-A2 AZABENZIMIDAZOLYL COMPOUNDS AS MGLUR2 POTENTIATORS PFIZER PRODUCTS INC. (US) 2007-11-29 WO disclosed