SCHEMBL20113103

SCHEMBL20113103

O=C(NCc1cccc(Cl)c1)C1c2ccccc2CC(=O)N1CC1CC1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 1/20 0.65
P2RX7 Q99572 3/20 0.51
POLB P06746 1/20 0.48
MC4R P32245 1/20 0.47
F2 P00734 3/20 0.46
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
MEN1 O00255 1/20 0.42
CASP6 P55212 1/20 0.42
KMT2A Q03164 1/20 0.42
METAP2 P50579 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
SCHEMBL20112961 0.94 GRM7 (0.58) GRM7P2RX7POLBMC4RF2
SCHEMBL20113080 0.86 GRM7 (0.74) GRM7P2RX7MEN1KMT2A
SCHEMBL20112967 0.83 GRM7 (0.58) GRM7P2RX7POLBHSP90AA1HSP90AB1
SCHEMBL20113020 0.83 GRM7 (0.68) GRM7KMT2A
SCHEMBL20113019 0.83 GRM7 (0.68) GRM7HSP90AA1HSP90AB1KMT2A
SCHEMBL20113106 0.83 GRM7 (0.74) GRM7MEN1KMT2A
SCHEMBL20113104 0.83 GRM7 (0.74) GRM7MEN1KMT2A
SCHEMBL20112965 0.80 GRM7 (0.57) GRM7P2RX7MEN1KMT2A
SCHEMBL20112956 0.80 GRM7 (0.62) GRM7P2RX7HSP90AA1HSP90AB1
SCHEMBL20112958 0.80 GRM7 (0.59) GRM7

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