SCHEMBL2019183

SCHEMBL2019183

CN[C@@H](C)C(=O)NCCF

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.37
TSHR P16473 1/20 0.37
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
ECE1 P42892 1/20 0.32
CACNA1B Q00975 2/20 0.31
ALDH1A2 O94788 1/20 0.31
ALDH2 P05091 1/20 0.31
ALDH1A3 P47895 1/20 0.31
ANPEP P15144 1/20 0.31
DNPEP Q9ULA0 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL2019186 1.00 USP2 (0.37) USP2TSHRKMT2AMEN1ALDH1A1
SCHEMBL13687952 0.80 KMT2A (0.54) USP2TSHRKMT2AMEN1ALDH1A1
SCHEMBL8037489 0.79
SCHEMBL13902934 0.79 USP2 (0.39) USP2TSHRKMT2AMEN1ALDH1A1
SCHEMBL15791951 0.79 CYP2D6 (0.35) USP2TSHRKMT2AMEN1ALDH1A1
SCHEMBL8956500 0.78 USP2 (0.37) USP2TSHRKMT2AMEN1ALDH1A1
SCHEMBL27738883 0.77
SCHEMBL15801447 0.76
SCHEMBL17694106 0.75 DPP7 (0.55) DPP7
SCHEMBL19580046 0.75 MEN1 (0.46) USP2TSHRKMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110160180-A1 Cannabinoid Receptor Ligands ASTRAZENECA AB (SE) 2011-06-30 US disclosed
US-20110160180-A1 Cannabinoid Receptor Ligands ASTRAZENECA AB (SE) 2011-06-30 US disclosed
US-20110160180-A1 Cannabinoid Receptor Ligands ASTRAZENECA AB (SE) 2011-06-30 US disclosed
EP-2190838-A1 CANNABINOID RECEPTOR LIGANDS AstraZeneca AB (SE) 2010-06-02 EP disclosed
US-20090062251-A1 Novel Compounds 002 ASTRAZENECA AB (SE) 2009-03-05 US disclosed
WO-2009024819-A1 CANNABINOID RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2009-02-26 WO disclosed
WO-2009024819-A1 CANNABINOID RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2009-02-26 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 (2 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-20090062251-A1 Novel Compounds 002 OPRL1, OPRK1, OPRM1 USP2 4486/4885TSHR 2124/4885KMT2A 2567/4885
US-20110160180-A1 Cannabinoid Receptor Ligands CNR1, CNR2, OPRL1 USP2 3947/4885TSHR 392/4885KMT2A 2050/4885

“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.