SCHEMBL5319461

SCHEMBL5319461

CCC(CCCCCN)C(N)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.52
CPB2 Q96IY4 5/20 0.46
RNPEP Q9H4A4 1/20 0.46
GNAI3 P08754 1/20 0.41
GNAO1 P09471 1/20 0.41
GNAI1 P63096 1/20 0.41
GRIK1 P39086 1/20 0.39
GRIK2 Q13002 1/20 0.39
ALDH1A1 P00352 2/20 0.38
SLC6A5 Q9Y345 1/20 0.38
MEN1 O00255 1/20 0.38
PLG P00747 1/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38
SLC6A2 P23975 1/20 0.38
RECQL P46063 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KMT2A Q03164 1/20 0.38
GPR84 Q9NQS5 3/20 0.37

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
SCHEMBL5321316 0.98 GSR (0.53) GSRCPB2RNPEPGNAI3GNAO1
SCHEMBL21054364 0.92 GSR (0.45) GSRCPB2RNPEPGRIK1GRIK2
SCHEMBL21054367 0.92 GSR (0.45) GSRCPB2RNPEPGRIK1GRIK2
SCHEMBL29634861 0.82 CA2 (0.52) GRIK1GRIK2GPR84FFAR1
SCHEMBL27637001 0.82 CA2 (0.52) GRIK1GRIK2GPR84FFAR1
SCHEMBL4774070 0.82 CA2 (0.52) GRIK1GRIK2GPR84FFAR1
SCHEMBL8662590 0.80 GRIK1 (0.49) GNAI3GNAO1GNAI1GRIK1GRIK2
SCHEMBL5323929 0.79 KMT2A (0.45) GRIK1GRIK2ALDH1A1MEN1ALOX15
SCHEMBL7193866 0.79 GPR84 (0.55) GRIK1GRIK2GPR84FFAR1
SCHEMBL3024374 0.79 GPR84 (0.55) GRIK1GRIK2GPR84FFAR1

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
US-20070258899-A1 Diagnostic and therapeutic agents KARYON-CTT LTD (FI) 2007-11-08 US disclosed
WO-2007113385-A1 DIAGNOSTIC AND THERAPEUTIC AGENTS KARYON-CTT LTD (FI) 2007-10-11 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-20070258899-A1 Diagnostic and therapeutic agents YBX1, MLX, TPX2 GSR 2317/4885CPB2 3185/4885RNPEP 1802/4885

“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.