SCHEMBL7474147

SCHEMBL7474147

O=C1NC(=O)C(c2ccccc2)(N2CCN(c3ccccc3)CC2)C(=O)N1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 15/20 0.64
MMP9 P14780 15/20 0.64
MMP8 P22894 3/20 0.56
MMP3 P08254 1/20 0.56
MAPT P10636 2/20 0.51
ADRA1B P35368 1/20 0.51
MMP13 P45452 2/20 0.51

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
SCHEMBL7480990 0.90 MMP2 (0.58) MMP2MMP9MMP8MMP3MAPT
SCHEMBL7478205 0.87 MAPT (0.72) MMP2MMP9MMP8MAPTMMP13
SCHEMBL7475919 0.86 MMP2 (0.87) MMP2MMP9MMP8MMP3MAPT
SCHEMBL7477228 0.85 MMP2 (0.57) MMP2MMP9MMP8MAPTMMP13
SCHEMBL7483991 0.84 MAPT (0.73) MMP2MMP9MMP8MMP3MAPT
SCHEMBL4664602 0.83 MMP2 (0.72) MMP2MMP9MMP8MMP3MAPT
SCHEMBL7484264 0.82 MMP8 (0.59) MMP2MMP9MMP8MMP3MMP13
SCHEMBL4664591 0.81 MMP2 (0.69) MMP2MMP9MMP8MMP3MAPT
SCHEMBL8471189 0.79 MMP2 (0.80) MMP2MMP9MMP8MMP3MMP13
SCHEMBL726759 0.79 MMP2 (1.00) MMP2MMP9MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0869947-B1 BARBITURIC ACID DERIVATIVES, PROCESSES FOR THEIR PRODUCTION AND PHARMACEUTICAL AGENTS CONTAINING THESE COMPOUNDS ROCHE DIAGNOSTICS GMBH (DE) 2002-10-23 EP disclosed