SCHEMBL1966352

SCHEMBL1966352

COc1cccc(N2CC[C@H](NC(=O)CC(C)C)C2)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 2/20 0.74
MTNR1A P48039 1/20 0.74
SIGMAR1 Q99720 1/20 0.48
NPY5R Q15761 1/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
GFER P55789 2/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C19 P33261 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
F10 P00742 1/20 0.45
ALDH1A1 P00352 2/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
MCL1 Q07820 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
DRD2 P14416 1/20 0.44

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
SCHEMBL1966354 1.00 MTNR1B (0.74) MTNR1BMTNR1ASIGMAR1NPY5RMEN1
SCHEMBL1967518 0.87 MTNR1A (0.83) MTNR1BMTNR1ASIGMAR1NPY5RMEN1
SCHEMBL1964369 0.87 MTNR1A (0.83) MTNR1BMTNR1ASIGMAR1NPY5RMEN1
SCHEMBL10324092 0.85 MTNR1B (1.00) MTNR1BMTNR1ASIGMAR1NPY5RMEN1
SCHEMBL10324093 0.85 MTNR1B (1.00) MTNR1BMTNR1ASIGMAR1NPY5RMEN1
SCHEMBL1966085 0.85 MTNR1A (0.69) MTNR1BMTNR1ANPY5RMEN1KMT2A
SCHEMBL1969779 0.85 MTNR1A (0.69) MTNR1BMTNR1ANPY5RMEN1KMT2A
SCHEMBL1965545 0.83 MTNR1A (0.73) MTNR1BMTNR1ASIGMAR1NPY5RMEN1
SCHEMBL1965540 0.83 MTNR1A (0.73) MTNR1BMTNR1ASIGMAR1NPY5RMEN1
SCHEMBL1966281 0.83 MTNR1A (0.88) MTNR1BMTNR1ASIGMAR1NPY5RLMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120184594-A1 PHENYLPYRROLIDINE COMPOUNDS FERRER INTERNACIONAL S.A. (ES) 2012-07-19 US claimed
EP-2203422-B1 PHENYLPYRROLIDINE COMPOUNDS FERRER INT (ES) 2011-06-22 EP claimed
US-20120184594-A1 PHENYLPYRROLIDINE COMPOUNDS FERRER INTERNACIONAL S.A. (ES) 2012-07-19 US disclosed
EP-2203422-B1 PHENYLPYRROLIDINE COMPOUNDS FERRER INT (ES) 2011-06-22 EP 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-20120184594-A1 PHENYLPYRROLIDINE COMPOUNDS MTNR1A, MTNR1B, MC4R MTNR1B 2/4885MTNR1A 1/4885SIGMAR1 1218/4885

“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.