SCHEMBL3523233

SCHEMBL3523233

COc1cccc(F)c1CN1CCOC(C(=O)N(Cc2ccc3c(c2)OCCCO3)CC(C)C)C1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PROKR2 Q8NFJ6 4/20 0.67
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 1/20 0.39
PDCD1 Q15116 7/20 0.38
CD274 Q9NZQ7 7/20 0.38
LMNA P02545 1/20 0.37
GLA P06280 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GRIN2B Q13224 1/20 0.37
APOBEC3A P31941 1/20 0.36
APOBEC3G Q9HC16 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
SCHEMBL3518512 0.95 PROKR2 (0.65) PROKR2KDM4EPDCD1CD274LMNA
SCHEMBL3517978 0.90 PROKR2 (0.65) PROKR2KDM4EPDCD1CD274LMNA
SCHEMBL3520056 0.89 PROKR2 (0.83) PROKR2KDM4EGLAAPOBEC3AAPOBEC3G
SCHEMBL3521885 0.89 PROKR2 (0.83) PROKR2KDM4EGLAAPOBEC3AAPOBEC3G
SCHEMBL3518904 0.88 PROKR2 (0.63) PROKR2KDM4EMAPK1LMNAGLA
SCHEMBL3518617 0.88 PROKR2 (0.68) PROKR2KDM4EMAPK1LMNAGRIN2B
SCHEMBL3518632 0.88 PROKR2 (0.64) PROKR2KDM4EMAPK1PDCD1CD274
SCHEMBL3518689 0.88 PROKR2 (0.64) PROKR2KDM4EMAPK1PDCD1CD274
SCHEMBL3517284 0.88 PROKR2 (0.66) PROKR2KDM4EMAPK1PDCD1CD274
SCHEMBL3518055 0.88 PROKR2 (0.62) PROKR2KDM4EPDCD1CD274LMNA

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 4734/4885MAPK1 1374/4885

“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.