SCHEMBL9706890

SCHEMBL9706890

CN1C(=O)CN(C(=O)c2ccccc2)[C@@H]1C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.42
CNR2 P34972 1/20 0.41
PIK3CD O00329 1/20 0.40
ALDH1A1 P00352 3/20 0.39
TSHR P16473 2/20 0.39
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ABCB1 P08183 1/20 0.39
ACHE P22303 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 1/20 0.38
ADRB2 P07550 1/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL7193232 1.00 RBP4 (0.42) RBP4CNR2PIK3CDALDH1A1TSHR
SCHEMBL8238415 1.00 RBP4 (0.42) RBP4CNR2PIK3CDALDH1A1TSHR
SCHEMBL8232622 0.86 PARP1 (0.42) RBP4PIK3CDALDH1A1TSHRRECQL
SCHEMBL7558692 0.86 PARP1 (0.42) RBP4PIK3CDALDH1A1TSHRRECQL
SCHEMBL7558696 0.86 PARP1 (0.42) RBP4PIK3CDALDH1A1TSHRRECQL
SCHEMBL1704378 0.86 CNR2 (0.36) CNR2ALDH1A1
SCHEMBL3054057 0.86 CNR2 (0.36) CNR2ALDH1A1
SCHEMBL584199 0.79 CNR2 (0.37) CNR2POLB
SCHEMBL10735686 0.71 CNR2 (0.35) CNR2
SCHEMBL4161364 0.71 CHRM2 (0.38) CNR2SMN1; SMN2KMT2AMAPT

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-0237630-B1 PROCESS FOR THE PREPARATION OF CHIRAL GLYCINE DERIVATIVES Degussa Aktiengesellschaft (DE) 1992-07-15 EP disclosed
EP-0237630-A2 Process for the preparation of chiral glycine derivatives Degussa Aktiengesellschaft (DE) 1987-09-23 EP disclosed