SCHEMBL1502974

SCHEMBL1502974

Cn1c(=O)n(CC2CC2(F)F)c2ccc(N3CCCCCCC3)nc21

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 9/20 0.64
PARG Q86W56 5/20 0.43
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 3/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL1502926 1.00 GRM2 (0.64) GRM2PARGNPSR1LMNAMAPT
SCHEMBL1502968 1.00 GRM2 (0.64) GRM2PARGNPSR1LMNAMAPT
SCHEMBL1503038 0.99 GRM2 (0.61) GRM2PARGNPSR1LMNAMAPT
SCHEMBL6891162 0.89 GRM2 (0.50) GRM2PARGNPSR1TSHRALDH1A1
SCHEMBL6891440 0.88 GRM2 (0.49) GRM2PARGNPSR1LMNAMAPT
SCHEMBL6893791 0.84 GRM2 (0.52) GRM2PARGTSHRALDH1A1
SCHEMBL6891306 0.84 GRM2 (0.52) GRM2PARGTSHRALDH1A1
SCHEMBL6892255 0.84 GRM2 (0.52) GRM2PARGTSHRALDH1A1
SCHEMBL1503122 0.83 ALDH1A1 (0.46) GRM2PARGLMNAMAPTTSHR
SCHEMBL1502970 0.83 GRM2 (0.50) GRM2PARGNPSR1LMNATSHR

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
WO-2011034741-A1 IMIDAZOPYRIDIN-2-ONE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2011-03-24 WO claimed
WO-2011034741-A1 IMIDAZOPYRIDIN-2-ONE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2011-03-24 WO disclosed