SCHEMBL3521285

SCHEMBL3521285

CC(C)CN(Cc1ccc2c(c1)OCCO2)C(=O)C1CN(Cc2ccc(N(C)C)cc2)CCO1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 4/20 0.58
HTT P42858 2/20 0.41
GRN P28799 1/20 0.41
SORT1 Q99523 1/20 0.41
NPC1 O15118 1/20 0.41
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP2D6 P10635 1/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
AGTR2 P50052 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRK1 P41145 1/20 0.36

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
SCHEMBL3520200 0.91 PROKR2 (0.59) PROKR2GRNSORT1NPC1KDM4E
SCHEMBL3518033 0.91 PROKR2 (0.59) PROKR2GRNSORT1NPC1KDM4E
SCHEMBL3517248 0.91 PROKR2 (0.64) PROKR2HTTGRNSORT1KDM4E
SCHEMBL3518041 0.91 PROKR2 (0.59) PROKR2GRNSORT1NPC1KDM4E
SCHEMBL3521944 0.90 PROKR2 (0.63) PROKR2HTTGRNSORT1KDM4E
SCHEMBL3516520 0.90 PROKR2 (0.60) PROKR2HTTKDM4EKMT2AALDH1A1
SCHEMBL3518564 0.89 PROKR2 (0.61) PROKR2GRNSORT1NPC1KDM4E
SCHEMBL3516623 0.89 PROKR2 (0.63) PROKR2GRNSORT1NPC1KDM4E
SCHEMBL3518034 0.89 PROKR2 (0.57) PROKR2HTTGRNSORT1KDM4E
SCHEMBL3517508 0.89 PROKR2 (0.63) PROKR2GRNSORT1NPC1KDM4E

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-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 1/4885HTT 357/4885GRN 562/4885

“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.