SCHEMBL7270210

SCHEMBL7270210

O=C1NC[C@@](Cc2ccccc2)(C(=O)O)N1C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
GAA P10253 1/20 0.45
MAPK1 P28482 1/20 0.45
HTR2C P28335 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
APH1B Q8WW43 1/20 0.42
NCSTN Q92542 1/20 0.42
APH1A Q96BI3 1/20 0.42
PSENEN Q9NZ42 1/20 0.42
GLA P06280 1/20 0.41
CTRB1 P17538 1/20 0.40

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
SCHEMBL11285680 0.89 HTR2C (0.45) NPC1RAB9ASMN1; SMN2GAAMAPK1
SCHEMBL6001297 0.81 HTR2C (0.47) NPC1RAB9ASMN1; SMN2GAAMAPK1
SCHEMBL7264096 0.81 HTR2C (0.47) NPC1RAB9ASMN1; SMN2GAAMAPK1
SCHEMBL14673362 0.73
SCHEMBL18760220 0.73
SCHEMBL2202910 0.71 DDB1 (0.44) NPC1RAB9ASMN1; SMN2GAAMAPK1
SCHEMBL2202906 0.71 DDB1 (0.44) NPC1RAB9ASMN1; SMN2GAAMAPK1
SCHEMBL30155273 0.70 NPC1 (0.49) NPC1RAB9ASMN1; SMN2GAAMAPK1
SCHEMBL19994437 0.69 NPC1 (0.51) NPC1RAB9ASMN1; SMN2GAAMAPK1
SCHEMBL8522162 0.69 SMN1; SMN2 (0.56) NPC1RAB9ASMN1; SMN2GAAMAPK1

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
EP-0095163-A2 2-Oxo-imidazolidine compounds, a process for preparing the same and a pharmaceutical composition Tanabe Seiyaku Co., Ltd. (JP) 1983-11-30 EP disclosed