SCHEMBL516471

SCHEMBL516471

CCCCCCCCCCCCOCCC(N)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 3/20 0.57
GRIK2 Q13002 3/20 0.57
SLC1A2 P43004 3/20 0.54
SLC1A1 P43005 3/20 0.54
NOS3 P29474 1/20 0.53
NOS1 P29475 1/20 0.53
NOS2 P35228 1/20 0.53
SLC1A3 P43003 2/20 0.51
P2RY10 O00398 2/20 0.51
NOD1 Q9Y239 5/20 0.49
CES2 O00748 1/20 0.47
MEN1 O00255 1/20 0.46
THRB P10828 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 1/20 0.46
GPR84 Q9NQS5 3/20 0.44
FFAR1 O14842 1/20 0.44
DDAH1 O94760 1/20 0.44
PLA2G2C Q5R387 1/20 0.44

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
SCHEMBL4853808 0.93 NOS1 (0.56) GRIK1GRIK2SLC1A2SLC1A1NOS3
SCHEMBL4853803 0.93 NOS1 (0.56) GRIK1GRIK2SLC1A2SLC1A1NOS3
SCHEMBL8063263 0.87 GSR (0.52) GRIK1GRIK2SLC1A2SLC1A1NOS3
SCHEMBL10136300 0.86 CES2 (0.52) GRIK1GRIK2SLC1A2SLC1A1NOS3
SCHEMBL20751441 0.85 NOS1 (0.59) GRIK1GRIK2SLC1A2SLC1A1NOS3
SCHEMBL21952409 0.85 NOS1 (0.59) GRIK1GRIK2SLC1A2SLC1A1NOS3
Aspartic Acid SCHEMBL27938168 0.84 GRIK1 (0.51) GRIK1GRIK2SLC1A2SLC1A1SLC1A3
SCHEMBL19951694 0.84 P2RY10 (0.56) GRIK1GRIK2SLC1A2SLC1A1NOS3
SCHEMBL10073281 0.84 P2RY10 (0.56) GRIK1GRIK2SLC1A2SLC1A1NOS3
SCHEMBL12203832 0.84 P2RY10 (0.56) GRIK1GRIK2SLC1A2SLC1A1NOS3

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2566494-B1 CXCR4 RECEPTOR COMPOUNDS ACER THERAPEUTICS INC (US) 2017-11-29 EP disclosed
EP-2566494-B1 CXCR4 RECEPTOR COMPOUNDS ACER THERAPEUTICS INC (US) 2017-11-29 EP disclosed
US-20160159861-A1 APJ Receptor Compounds ANCHOR THERAPEUTICS, INC. (US) 2016-06-09 US disclosed
US-20160159861-A1 APJ Receptor Compounds ANCHOR THERAPEUTICS, INC. (US) 2016-06-09 US disclosed
EP-3021861-A1 APJ RECEPTOR COMPOUNDS Anchor Therapeutics, Inc. (US) 2016-05-25 EP disclosed
US-9155795-B2 CXCR4 receptor compounds ANCHOR THERAPEUTICS, INC. (US) 2015-10-13 US disclosed
US-9155795-B2 CXCR4 receptor compounds ANCHOR THERAPEUTICS, INC. (US) 2015-10-13 US disclosed
US-9096646-B2 CXCR4 receptor compounds ANCHOR THERAPEUTICS, INC. (US) 2015-08-04 US disclosed
US-9096646-B2 CXCR4 receptor compounds ANCHOR THERAPEUTICS, INC. (US) 2015-08-04 US disclosed
WO-2015010045-A1 APJ RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2015-01-22 WO disclosed
WO-2011106703-A2 CXCR4 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2011-09-01 WO disclosed
WO-2010053547-A2 CXCR5 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed
WO-2010053547-A2 CXCR5 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed
WO-2010053550-A2 CXCR4 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed
WO-2010053548-A2 PTHR1 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed
WO-2010053548-A2 PTHR1 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed
WO-2010053546-A2 CRF1 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed
WO-2010053546-A2 CRF1 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed
WO-2010053545-A2 APJ RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed
WO-2010053545-A2 APJ RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. (US) 2010-05-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160159861-A1 APJ Receptor Compounds APLNR, AP1G1, AP2B1 GRIK1 1073/4885GRIK2 1148/4885SLC1A2 2306/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.