SCHEMBL5315528

SCHEMBL5315528

O=C1OCCN1Cc1ccc(O)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 4/20 0.53
NAAA Q02083 2/20 0.50
FAAH O00519 1/20 0.50
LTA4H P09960 1/20 0.49
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
KCNH2 Q12809 2/20 0.42
NR1I2 O75469 1/20 0.42
GRIN2B Q13224 1/20 0.41

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
SCHEMBL16881052 0.83 GRM2 (0.53) GRM2LTA4HALDH1A1POLBKCNH2
SCHEMBL5216969 0.83 GRM2 (0.53) GRM2NAAAFAAHLTA4HALDH1A1
SCHEMBL259624 0.83 GRM2 (0.53) GRM2NAAAFAAHLTA4HALDH1A1
SCHEMBL14002387 0.83 SMN1; SMN2 (0.55) GRM2NAAALTA4HALDH1A1POLB
SCHEMBL531434 0.82 GRM2 (0.52) GRM2NAAAFAAHLTA4HPOLB
SCHEMBL16610628 0.82 GRM2 (0.50) GRM2NAAAFAAHLTA4HALDH1A1
SCHEMBL14687303 0.82 GRM2 (0.50) GRM2NAAAFAAHLTA4HALDH1A1
SCHEMBL5248237 0.81 GRM2 (0.49) GRM2NAAAFAAHLTA4HALDH1A1
SCHEMBL4519506 0.81 GRM2 (0.51) GRM2NAAAFAAHLTA4HPOLB
SCHEMBL30996376 0.79 GRM2 (0.60) GRM2POLB

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-2007029062-A2 NOVEL PYRIDINE DERIVATIVES ORCHID RESEARCH LABORATORIES LIMITED (IN) 2007-03-15 WO disclosed