SCHEMBL20168240

SCHEMBL20168240

C[C@H](C(=O)N[C@H]1COc2ccccc2[C@@H]1[As](C)C)c1ccc(F)cc1

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 9/20 0.70
P2RX7 Q99572 2/20 0.39
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
POLB P06746 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
AIMP2 Q13155 1/20 0.33

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
SCHEMBL20168242 1.00 GRM7 (0.70) GRM7P2RX7MEN1KMT2APOLB
SCHEMBL20168241 1.00 GRM7 (0.70) GRM7P2RX7MEN1KMT2APOLB
SCHEMBL20182770 0.87 GRM7 (0.76) GRM7P2RX7MEN1KMT2AAIMP2
SCHEMBL21542214 0.87 GRM7 (0.76) GRM7P2RX7MEN1KMT2AAIMP2
SCHEMBL21542216 0.87 GRM7 (0.76) GRM7P2RX7MEN1KMT2AAIMP2
SCHEMBL21542200 0.85 GRM7 (0.70) GRM7P2RX7MEN1KMT2ATRPM8
SCHEMBL21542201 0.85 GRM7 (0.70) GRM7P2RX7MEN1KMT2ATRPM8
SCHEMBL20182839 0.85 GRM7 (0.70) GRM7P2RX7MEN1KMT2ATRPM8
SCHEMBL21542337 0.84 GRM7 (0.71) GRM7P2RX7MEN1KMT2AAIMP2
SCHEMBL21542339 0.84 GRM7 (0.71) GRM7P2RX7MEN1KMT2AAIMP2

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
EP-3541812-A1 MGLUR7 AGONIST COMPOUNDS FOR TREATING MGLUR7- REGULATED DISEASES, DISORDERS, OR CONDITIONS Takeda Pharmaceutical Company Limited (JP) 2019-09-25 EP disclosed
WO-2018092921-A1 MGLUR7 AGONIST COMPOUNDS FOR TREATING MGLUR7- REGULATED DISEASES, DISORDERS, OR CONDITIONS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-05-24 WO disclosed