SCHEMBL6906235

SCHEMBL6906235

CCOC(=O)C1C2C(NC(=O)c3cccc(Cl)c3)CC(NC(=O)OC(C)(C)C)(C(=O)OCC)C12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 4/20 0.47
GRM3 Q14832 4/20 0.47
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TRPV1 Q8NER1 1/20 0.38
GRM6 O15303 1/20 0.37
GRM4 Q14833 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CHRM1 P11229 2/20 0.36
CHRM5 P08912 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
GRM5 P41594 2/20 0.35
P2RX7 Q99572 1/20 0.35
CPB2 Q96IY4 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL6906238 1.00 GRM2 (0.47) GRM2GRM3KMT2AMEN1SMN1; SMN2
SCHEMBL6909803 0.92 GRM2 (0.36) GRM2GRM3KMT2AMEN1GRM6
SCHEMBL6909800 0.92 GRM2 (0.36) GRM2GRM3KMT2AMEN1GRM6
SCHEMBL6911744 0.91 GRM2 (0.38) GRM2GRM3GRM6GRM4L3MBTL1
SCHEMBL6901983 0.91 GRM2 (0.40) GRM2GRM3SMN1; SMN2GRM6GRM4
SCHEMBL6911749 0.91 GRM2 (0.38) GRM2GRM3GRM6GRM4L3MBTL1
SCHEMBL6901988 0.91 GRM2 (0.40) GRM2GRM3SMN1; SMN2GRM6GRM4
SCHEMBL6916637 0.90 GRM2 (0.47) GRM2GRM3KMT2AMEN1SMN1; SMN2
SCHEMBL6916632 0.90 GRM2 (0.47) GRM2GRM3KMT2AMEN1SMN1; SMN2
SCHEMBL6904292 0.90 GRM2 (0.43) GRM2GRM3KMT2AMEN1SMN1; SMN2

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-20040116489-A1 Synthetic excitatory amino acids ELI LILLY AND COMPANY 2004-06-17 US disclosed