SCHEMBL14625979

SCHEMBL14625979

O=CN1CCC(NC(=O)c2ccccn2)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 5/20 0.62
SMYD3 Q9H7B4 1/20 0.59
KMT2A Q03164 2/20 0.54
GAA P10253 2/20 0.54
KDM4E B2RXH2 1/20 0.54
EPHX2 P34913 2/20 0.53
MEN1 O00255 1/20 0.50
KDM5A P29375 1/20 0.49
CYP1A2 P05177 1/20 0.49
EGFR P00533 1/20 0.48
ERBB2 P04626 1/20 0.48
MET P08581 1/20 0.48
KDR P35968 1/20 0.48
MERTK Q12866 1/20 0.48
CRBN Q96SW2 1/20 0.48
USP30 Q70CQ3 3/20 0.47
PRKAB2 O43741 1/20 0.47
PRKAG1 P54619 1/20 0.47
PRKAA2 P54646 1/20 0.47
PRKAA1 Q13131 1/20 0.47

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
SCHEMBL2241357 0.85 GRM5 (0.77) GRM5SMYD3KMT2AGAAKDM4E
SCHEMBL25053100 0.84 GRM5 (0.63) GRM5SMYD3KMT2AGAAKDM4E
SCHEMBL8062288 0.83 EPHX2 (0.74) GRM5SMYD3KMT2AGAAKDM4E
SCHEMBL8212053 0.83 PRKAA2 (0.51) GRM5SMYD3KMT2AMEN1USP30
SCHEMBL14067296 0.82 GRM5 (0.60) GRM5SMYD3KMT2AGAAKDM4E
SCHEMBL2246381 0.82 GRM5 (0.82) GRM5SMYD3KMT2AGAAKDM4E
SCHEMBL16394406 0.82 GRM5 (0.88) GRM5SMYD3KMT2AGAAKDM4E
SCHEMBL5315579 0.81 SMYD3 (0.60) GRM5SMYD3KMT2AGAAKDM4E
SCHEMBL5316723 0.81 GRM5 (0.59) GRM5SMYD3KMT2AGAAKDM4E
SCHEMBL22449377 0.81 GRM5 (0.80) GRM5SMYD3KMT2AGAAKDM4E

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-7160877-B2 Aliphatic nitrogen-containing 5-membered ring compound TANABE SEIYAKU CO., LTD. (JP) 2007-01-09 US disclosed