SCHEMBL3521163

SCHEMBL3521163

CC(C)CN(Cc1ccc2c(c1)OCCO2)C(=O)C1CN(Cc2ccccn2)CCO1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 4/20 0.53
GAA P10253 1/20 0.41
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
SSTR3 P32745 1/20 0.37
KDM4E B2RXH2 2/20 0.37
FAAH O00519 1/20 0.36
LMNA P02545 2/20 0.36
RXRB P28702 1/20 0.36
MCHR1 Q99705 1/20 0.36
POLB P06746 2/20 0.36
CHRM5 P08912 1/20 0.36
PMP22 Q01453 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL3521064 0.89 PROKR2 (0.51) PROKR2GAAKDM4ERXRBALDH1A1
SCHEMBL3518041 0.88 PROKR2 (0.59) PROKR2GAANPC1RAB9AKDM4E
SCHEMBL3520200 0.88 PROKR2 (0.59) PROKR2GAANPC1RAB9AKDM4E
SCHEMBL3518033 0.88 PROKR2 (0.59) PROKR2GAANPC1RAB9AKDM4E
SCHEMBL3522379 0.88 PROKR2 (0.52) PROKR2GAANPC1RAB9AKDM4E
SCHEMBL12993038 0.87 PROKR2 (0.57) PROKR2GAASSTR3KDM4EFAAH
SCHEMBL3519848 0.87 PROKR2 (0.53) PROKR2NPC1RAB9AKDM4ELMNA
SCHEMBL3519032 0.86 PROKR2 (0.48) PROKR2GAASSTR3KDM4ELMNA
SCHEMBL3518818 0.86 PROKR2 (0.51) PROKR2GAAKDM4EMCHR1ALDH1A1
SCHEMBL3518893 0.86 PROKR2 (0.52) PROKR2GAANPC1RAB9AKDM4E

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 1/4885GAA 773/4885NPC1 2373/4885

“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.