SCHEMBL3522305

SCHEMBL3522305

COc1cc(CN2CCOC(C(=O)N(Cc3ccc4c(c3)OCCCO4)CC(C)C)C2)ccc1C

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 4/20 0.70
MCHR1 Q99705 4/20 0.47
KDM4E B2RXH2 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.39
GLA P06280 1/20 0.39
DRD4 P21917 2/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 1/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38

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
SCHEMBL14514874 1.00 PROKR2 (0.70) PROKR2MCHR1KDM4ESMN1; SMN2GLA
SCHEMBL3521885 0.92 PROKR2 (0.83) PROKR2MCHR1KDM4ESMN1; SMN2GLA
SCHEMBL3520056 0.92 PROKR2 (0.83) PROKR2MCHR1KDM4ESMN1; SMN2GLA
SCHEMBL3520320 0.89 PROKR2 (0.58) PROKR2KDM4ESMN1; SMN2DRD4KMT2A
SCHEMBL3518512 0.88 PROKR2 (0.65) PROKR2KDM4ESMN1; SMN2GLAALDH1A1
SCHEMBL3518632 0.88 PROKR2 (0.64) PROKR2MCHR1KDM4ESMN1; SMN2DRD4
SCHEMBL3516827 0.88 PROKR2 (0.64) PROKR2MCHR1KDM4EGLADRD4
SCHEMBL3518689 0.88 PROKR2 (0.64) PROKR2MCHR1KDM4ESMN1; SMN2DRD4
SCHEMBL3520997 0.86 PROKR2 (0.64) PROKR2MCHR1KDM4ESMN1; SMN2GLA
SCHEMBL3518617 0.86 PROKR2 (0.68) PROKR2MCHR1KDM4ESMN1; SMN2DRD4

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 1/4885MCHR1 32/4885KDM4E 4734/4885

“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.