SCHEMBL8685385

SCHEMBL8685385

O=C(O)NCCC(Cl)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
CNR1 P21554 9/20 0.50
CNR2 P34972 7/20 0.50
EPHX2 P34913 4/20 0.50
CASR P41180 5/20 0.45

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
SCHEMBL17594860 0.89 MTNR1A (0.45) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL2726416 0.82 MTNR1A (0.72) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL8684995 0.81 BCAT2 (0.46) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL3510106 0.79 MTNR1A (0.53) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL8206471 0.79 CNR1 (0.47) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL3505478 0.78 MTNR1A (0.51) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL28441186 0.78 MTNR1A (0.51) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL1426449 0.78 MTNR1A (0.56) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL31505725 0.76 HTR2A (0.58) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL7415154 0.75 MTNR1A (0.49) MTNR1AMTNR1BCNR1CNR2EPHX2

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
CN-1283617-A Terazololine-one NIPPON BAYER AGROCHEM K K (JP) 2001-02-14 CN disclosed
US-5747420-A HERBICIDES NIHON BAYER AGROCHEM K.K. (JP) 1998-05-05 US disclosed
CN-1132748-A Tetrazolinones BAYER AGROCHEM KK (JP) 1996-10-09 CN disclosed
EP-0711761-A1 Tetrazolinones NIHON BAYER AGROCHEM K.K. (JP) 1996-05-15 EP disclosed