SCHEMBL30679003

SCHEMBL30679003

Cn1c(CN2CCC[C@@H]2[C@H]2CCCN2Cc2nc3ccccc3n2C)nc2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 12/20 0.59
DRD2 P14416 7/20 0.59
DRD4 P21917 6/20 0.59
DRD3 P35462 5/20 0.59
LMNA P02545 3/20 0.54
KMT2A Q03164 1/20 0.54
PKM P14618 1/20 0.52
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL19839930 0.83 KDM4E (0.56) GRM2LMNAKMT2APKMSMN1; SMN2
SCHEMBL3983436 0.80 GRM2 (0.55) GRM2DRD2DRD4DRD3LMNA
SCHEMBL14374007 0.79 GRM2 (0.72) GRM2DRD2DRD4DRD3LMNA
SCHEMBL5156990 0.79 GRM2 (0.81) GRM2DRD2DRD4DRD3LMNA
SCHEMBL4139937 0.78 GRM2 (0.70) GRM2DRD2DRD4DRD3LMNA
SCHEMBL4931423 0.76 GRM2 (0.72) GRM2DRD2DRD4DRD3LMNA
SCHEMBL12629355 0.75 GRM2 (0.67) GRM2DRD2DRD4DRD3LMNA
SCHEMBL14197759 0.75 GRM2 (0.67) GRM2DRD2DRD4DRD3LMNA
SCHEMBL14685201 0.74 DDB1 (0.58) GRM2DRD2DRD4DRD3LMNA
SCHEMBL4147514 0.74 GRM2 (1.00) GRM2DRD2DRD4DRD3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4249470-B1 METHOD FOR PREPARING ALPHA-AMINO ACIDS PHILIPPS UNIV MARBURG (DE) 2024-11-13 EP disclosed
EP-4332089-A1 METHOD FOR PREPARING AMINO ACIDS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2024-03-06 EP disclosed
EP-4249470-A1 METHOD FOR PREPARING ALPHA-AMINO ACIDS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2023-09-27 EP disclosed