SCHEMBL3516665

SCHEMBL3516665

CC(C)CN(Cc1ccc2c(c1)OCCO2)C(=O)C1CN(Cc2cccc(-c3ccccc3)c2)CCO1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 4/20 0.55
CYP2D6 P10635 1/20 0.44
ALDH1A1 P00352 2/20 0.42
GAA P10253 1/20 0.42
POLB P06746 2/20 0.41
HTR1A P08908 1/20 0.41
DRD2 P14416 1/20 0.41
FAAH O00519 1/20 0.41
GRN P28799 1/20 0.41
SORT1 Q99523 1/20 0.41
KDM4E B2RXH2 1/20 0.40
OPRD1 P41143 1/20 0.40
UBE2M P61081 1/20 0.40
DCUN1D1 Q96GG9 1/20 0.40
MCHR1 Q99705 1/20 0.40
GLA P06280 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM3 P20309 3/20 0.39
PTGES O14684 1/20 0.39

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
SCHEMBL3516502 0.94 PROKR2 (0.57) PROKR2CYP2D6ALDH1A1GAAPOLB
SCHEMBL3518033 0.93 PROKR2 (0.59) PROKR2CYP2D6ALDH1A1GAAPOLB
SCHEMBL3518041 0.93 PROKR2 (0.59) PROKR2CYP2D6ALDH1A1GAAPOLB
SCHEMBL3520200 0.93 PROKR2 (0.59) PROKR2CYP2D6ALDH1A1GAAPOLB
SCHEMBL3521820 0.91 PROKR2 (0.52) PROKR2CYP2D6ALDH1A1GAAPOLB
SCHEMBL3516623 0.91 PROKR2 (0.63) PROKR2CYP2D6ALDH1A1GAAPOLB
SCHEMBL3517508 0.91 PROKR2 (0.63) PROKR2CYP2D6ALDH1A1GAAPOLB
SCHEMBL387975 0.91 PROKR2 (0.63) PROKR2CYP2D6ALDH1A1GAAPOLB
SCHEMBL3518564 0.91 PROKR2 (0.61) PROKR2CYP2D6ALDH1A1GAAPOLB
SCHEMBL3517627 0.90 PROKR2 (0.60) PROKR2CYP2D6ALDH1A1GAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1959959-B1 MORPHOLINE CARBOXAMIDE PROKINETICIN RECEPTOR ANTAGONISTS MERCK SHARP & DOHME (US) 2013-04-10 EP claimed
US-7855201-B2 Morpholine carboxamide prokineticin receptor antagonists Merck Sharp & Dohme. Corp. (US) 2010-12-21 US claimed
US-20090306076-A1 Morpholine Carboxamide Prokineticin Receptor Antagonists MERCK SHARP & DOHME LLC 2009-12-10 US claimed
EP-1959959-A2 MORPHOLINE CARBOXAMIDE PROKINETICIN RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 2008-08-27 EP claimed
WO-2007067511-A2 MORPHOLINE CARBOXAMIDE PROKINETICIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2007-06-14 WO claimed
EP-1959959-B1 MORPHOLINE CARBOXAMIDE PROKINETICIN RECEPTOR ANTAGONISTS MERCK SHARP & DOHME (US) 2013-04-10 EP disclosed
US-7855201-B2 Morpholine carboxamide prokineticin receptor antagonists Merck Sharp & Dohme. Corp. (US) 2010-12-21 US disclosed
US-7855201-B2 Morpholine carboxamide prokineticin receptor antagonists Merck Sharp & Dohme. Corp. (US) 2010-12-21 US disclosed
US-7855201-B2 Morpholine carboxamide prokineticin receptor antagonists Merck Sharp & Dohme. Corp. (US) 2010-12-21 US disclosed
US-20090306076-A1 Morpholine Carboxamide Prokineticin Receptor Antagonists MERCK SHARP & DOHME LLC 2009-12-10 US disclosed
US-20090306076-A1 Morpholine Carboxamide Prokineticin Receptor Antagonists MERCK SHARP & DOHME LLC 2009-12-10 US disclosed
US-20090306076-A1 Morpholine Carboxamide Prokineticin Receptor Antagonists MERCK SHARP & DOHME LLC 2009-12-10 US 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-20090306076-A1 Morpholine Carboxamide Prokineticin Receptor Antagonists PROKR2, PROKR1, NTSR2 PROKR2 1/4885CYP2D6 2560/4885ALDH1A1 4629/4885

“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.