SCHEMBL3523083

SCHEMBL3523083

CCOc1ccccc1CN1CCOC(C(=O)N(Cc2ccc3c(c2)OCCCO3)CC(C)C)C1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 4/20 0.58
KDM4E B2RXH2 1/20 0.39
DRD4 P21917 3/20 0.39
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
POLB P06746 2/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
HPGD P15428 1/20 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
SCHEMBL3518689 0.92 PROKR2 (0.64) PROKR2KDM4EDRD4ALDH1A1MAPK1
SCHEMBL3518632 0.92 PROKR2 (0.64) PROKR2KDM4EDRD4ALDH1A1MAPK1
SCHEMBL3516884 0.91 PROKR2 (0.62) PROKR2KDM4EALDH1A1MAPK1HPGD
SCHEMBL12993123 0.91 PROKR2 (0.62) PROKR2KDM4EALDH1A1MAPK1HPGD
SCHEMBL3516850 0.90 PROKR2 (0.61) PROKR2KDM4EKMT2AALDH1A1MEN1
SCHEMBL3521313 0.90 PROKR2 (0.61) PROKR2KDM4EKMT2AALDH1A1MEN1
SCHEMBL3516864 0.90 PROKR2 (0.60) PROKR2KDM4EDRD4ALDH1A1MAPK1
SCHEMBL3516542 0.90 PROKR2 (0.60) PROKR2KDM4EDRD4ALDH1A1MAPK1
SCHEMBL3519004 0.90 PROKR2 (0.57) PROKR2KDM4EDRD4ALDH1A1
SCHEMBL10106705 0.89 PROKR2 (0.58) PROKR2KDM4EKMT2AMAPTALDH1A1

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 10 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-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 1/4885KDM4E 4734/4885DRD4 790/4885

“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.