SCHEMBL20113021

SCHEMBL20113021

Cc1ccccc1CNC(=O)[C@@H]1c2ccccc2CC(=O)N1CC1CC1

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 1/20 0.78
P2RX7 Q99572 10/20 0.52
KMT2A Q03164 2/20 0.50
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
EPHX2 P34913 1/20 0.41
GAA P10253 1/20 0.40

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
SCHEMBL20112955 0.88 GRM7 (1.00) GRM7P2RX7LMNAPOLBALDH1A1
SCHEMBL20113020 0.85 GRM7 (0.68) GRM7KMT2AALDH1A1GAA
SCHEMBL20113026 0.85 GRM7 (0.74) GRM7P2RX7KMT2AMEN1EPHX2
SCHEMBL20113180 0.84 GRM7 (0.69) GRM7P2RX7KMT2A
SCHEMBL19960417 0.82 GRM7 (0.66) GRM7LMNAGAA
SCHEMBL20113083 0.82 GRM7 (0.82) GRM7P2RX7KMT2AMEN1EPHX2
SCHEMBL20113019 0.81 GRM7 (0.68) GRM7KMT2ALMNAALDH1A1
SCHEMBL20113106 0.81 GRM7 (0.74) GRM7KMT2AMEN1ALDH1A1
SCHEMBL20113104 0.81 GRM7 (0.74) GRM7KMT2AMEN1ALDH1A1
SCHEMBL20113179 0.81 GRM7 (0.68) GRM7P2RX7KMT2ALMNA

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-2018079862-A1 MGLUR7 MODULATORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-05-03 WO disclosed