SCHEMBL7936878

SCHEMBL7936878

NC(=O)C1(C(N)=O)CC(OCc2ccccc2)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.46
EPHX2 P34913 2/20 0.45
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSK P43235 1/20 0.43
ALDH1A1 P00352 1/20 0.42
OPRM1 P35372 2/20 0.42
OPRL1 P41146 2/20 0.42
BDKRB2 P30411 2/20 0.42
ADAM17 P78536 1/20 0.41
GRM2 Q14416 1/20 0.41
GRM3 Q14832 1/20 0.41
SLC1A3 P43003 2/20 0.41
SLC1A2 P43004 2/20 0.41
SLC1A1 P43005 2/20 0.41
CYP2C19 P33261 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL8586277 0.88 DPP4 (0.51) DPP4EPHX2CTSLCTSBCTSK
SCHEMBL2640274 0.87 EPHX2 (0.47) DPP4EPHX2CTSLCTSBCTSK
SCHEMBL8050802 0.86 ADAM17 (0.43) DPP4EPHX2ALDH1A1OPRM1OPRL1
SCHEMBL31471412 0.86 DPP4 (0.44) DPP4EPHX2CTSLCTSBCTSK
SCHEMBL296907 0.81 GRM2 (0.47) DPP4EPHX2CTSLCTSBCTSK
SCHEMBL14409083 0.81 GRM2 (0.47) DPP4EPHX2CTSLCTSBCTSK
SCHEMBL871442 0.79 ADAM17 (0.46) EPHX2ALDH1A1OPRM1OPRL1ADAM17
SCHEMBL32676611 0.79 EPHX2 (0.44) DPP4EPHX2CTSLCTSBCTSK
SCHEMBL31471348 0.79 EPHX2 (0.46) DPP4EPHX2CTSLCTSBCTSK
SCHEMBL2787488 0.78 GRM2 (0.45) DPP4EPHX2CTSLCTSBCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7264792-B2 Solid phase preparation of 18F-labelled amino acids GE HEALTHCARE LIMITED (GB) 2007-09-04 US disclosed
US-7264792-B2 Solid phase preparation of 18F-labelled amino acids GE HEALTHCARE LIMITED (GB) 2007-09-04 US disclosed
EP-0862464-A4 AMINO ACID ANALOGS FOR TUMOR IMAGING UNIV EMORY (US) 2001-07-25 EP disclosed
US-5817776-A TECHNETIUM 99 COMPLEXES, SINGLE PHOTON EMISSION TOMOGRAPHY EMORY UNIVERSITY (US) 1998-10-06 US disclosed
US-5808146-A Amino acid analogs for tumor imaging EMORY UNIVERSITY (US) 1998-09-15 US disclosed
EP-0862464-A1 AMINO ACID ANALOGS FOR TUMOR IMAGING EMORY UNIVERSITY (US) 1998-09-09 EP disclosed
US-5723410-A PLANT GROWTH REGULATORS AND HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1998-03-03 US disclosed
WO-1997017092-A1 AMINO ACID ANALOGS FOR TUMOR IMAGING EMORY UNIVERSITY (US) 1997-05-15 WO disclosed