SCHEMBL3579104

SCHEMBL3579104

CC(CNC(=O)O)Oc1cccc(F)c1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 11/20 0.57
MTNR1B P49286 11/20 0.57
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ATM Q13315 1/20 0.49
SLC6A4 P31645 1/20 0.49
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
HPGD P15428 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.42

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
SCHEMBL3579103 1.00 MTNR1A (0.57) MTNR1AMTNR1BMEN1KMT2AATM
SCHEMBL11230310 0.92 MTNR1A (0.53) MTNR1AMTNR1BMEN1KMT2AATM
SCHEMBL10829122 0.80 MTNR1B (0.46) MTNR1AMTNR1BMEN1KMT2AATM
SCHEMBL9818797 0.80 PPARG (0.52) MTNR1AMTNR1BMEN1KMT2AATM
SCHEMBL10875225 0.77 HTR1D (0.47)
SCHEMBL30200767 0.77 MTNR1A (0.42) MTNR1AMTNR1BMEN1KMT2AATM
SCHEMBL2402576 0.76 MTNR1A (0.44) MTNR1AMTNR1B
SCHEMBL3577544 0.76 TRPV4 (0.46) MEN1KMT2APPARGPPARAHPGD
SCHEMBL20514905 0.76 MTNR1A (0.50) MTNR1AMTNR1B
SCHEMBL11212797 0.76 MTNR1A (0.53) MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7728005-B2 Ether derivative AJINOMOTO CO., INC. (JP) 2010-06-01 US disclosed
US-20060270693-A1 Ether derivative AJINOMOTO CO., INC. (JP) 2006-11-30 US disclosed
EP-1679296-A1 ETHER DERIVATIVE Ajinomoto Co., Inc. (JP) 2006-07-12 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-20060270693-A1 Ether derivative UROD, IL5, IL17A MTNR1A 1758/4885MTNR1B 1759/4885MEN1 4235/4885

“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.