SCHEMBL5702158

SCHEMBL5702158

O=C(O)[C@H]1CCN1c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.49
TFPI2 P48307 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 2/20 0.42
AGTR2 P50052 2/20 0.42
KMT2A Q03164 2/20 0.40
USP30 Q70CQ3 1/20 0.39
OGFRL1 Q5TC84 5/20 0.39
OPRM1 P35372 4/20 0.39
OPRK1 P41145 4/20 0.39
OPRD1 P41143 3/20 0.39
MEN1 O00255 1/20 0.38
SIGMAR1 Q99720 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
SCHEMBL5702089 1.00 NOTUM (0.49) NOTUMTFPI2SMN1; SMN2ALDH1A1AGTR2
SCHEMBL432319 0.89 SMN1; SMN2 (0.51) NOTUMSMN1; SMN2ALDH1A1KMT2AOGFRL1
SCHEMBL630857 0.89 SMN1; SMN2 (0.51) NOTUMSMN1; SMN2ALDH1A1KMT2AOGFRL1
SCHEMBL15664724 0.89 SMN1; SMN2 (0.51) NOTUMSMN1; SMN2ALDH1A1KMT2AOGFRL1
SCHEMBL13603832 0.87 SMN1; SMN2 (0.46) NOTUMSMN1; SMN2ALDH1A1KMT2AOGFRL1
SCHEMBL8104378 0.87 SMN1; SMN2 (0.46) NOTUMSMN1; SMN2ALDH1A1KMT2AOGFRL1
Hydrochloric Acid SCHEMBL28132801 0.87 SMN1; SMN2 (0.50) NOTUMSMN1; SMN2ALDH1A1KMT2AOGFRL1
SCHEMBL9432301 0.84 NOTUM (0.42) NOTUMTFPI2SMN1; SMN2ALDH1A1AGTR2
SCHEMBL28221339 0.84 NOTUM (0.54) NOTUMSMN1; SMN2
SCHEMBL4770098 0.83 NOTUM (0.38) NOTUMTFPI2SMN1; SMN2ALDH1A1OGFRL1

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-0974670-B1 Process for producing optically active N-substituted azetidine-2-carboxylic acid compound SUMITOMO CHEMICAL CO (JP) 2006-09-13 EP disclosed
US-6143554-A Process for producing optically active n-substituted azetidine-2 carboxylic acid compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-11-07 US disclosed
EP-0974670-A2 Process for producing optically active N-substituted azetidine-2-carboxylic acid compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-01-26 EP disclosed