SCHEMBL3518992

SCHEMBL3518992

COc1ncc(F)cc1CN1CCOC(C(=O)N(Cc2ccc3c(c2)OCCCO3)CC(C)C)C1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 4/20 0.61
KDM4E B2RXH2 2/20 0.41
GRIN2B Q13224 5/20 0.35
GLA P06280 1/20 0.35
MCHR1 Q99705 2/20 0.34
LMNA P02545 1/20 0.34
ALK Q9UM73 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33

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
SCHEMBL3521395 0.89 PROKR2 (0.57) PROKR2KDM4EGLAMCHR1LMNA
SCHEMBL3516681 0.89 PROKR2 (0.58) PROKR2KDM4EGLAMCHR1LMNA
SCHEMBL3518617 0.88 PROKR2 (0.68) PROKR2KDM4EGRIN2BMCHR1LMNA
SCHEMBL3517284 0.88 PROKR2 (0.66) PROKR2KDM4EMCHR1LMNAPDCD1
SCHEMBL3520486 0.87 PROKR2 (0.61) PROKR2KDM4EGLAMCHR1LMNA
SCHEMBL3517781 0.87 PROKR2 (0.61) PROKR2KDM4EGLAMCHR1SMN1; SMN2
SCHEMBL3519576 0.87 PROKR2 (0.61) PROKR2KDM4EGLAMCHR1LMNA
SCHEMBL3519144 0.87 PROKR2 (0.61) PROKR2KDM4EGLAMCHR1LMNA
SCHEMBL3520517 0.86 PROKR2 (0.55) PROKR2KDM4EGLALMNAPDCD1
SCHEMBL3520587 0.86 PROKR2 (0.65) PROKR2KDM4EGRIN2BLMNASMN1; SMN2

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 8 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-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 4734/4885GRIN2B 74/4885

“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.