SCHEMBL7672124

SCHEMBL7672124

O=C(O)C1CN(Cc2ccc(Oc3ccc(F)cc3)cc2)C(=O)N1

nearest known ligand 0.77

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 10/20 0.77
MMP2 P08253 6/20 0.77
MMP1 P03956 6/20 0.77
MMP3 P08254 3/20 0.77
MMP9 P14780 3/20 0.77
HTT P42858 1/20 0.51
S1PR5 Q9H228 2/20 0.47
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
LTA4H P09960 1/20 0.42
CTSD P07339 1/20 0.41
BACE1 P56817 1/20 0.41

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
SCHEMBL6691597 1.00 MMP13 (0.77) MMP13MMP2MMP1MMP3MMP9
SCHEMBL6693892 0.87 MMP13 (1.00) MMP13MMP2MMP1MMP3MMP9
SCHEMBL6692001 0.84 MMP13 (0.68) MMP13MMP2MMP1MMP3MMP9
SCHEMBL4293140 0.80 MMP13 (0.58) MMP13MMP2MMP1MMP3MMP9
SCHEMBL4293133 0.80 MMP13 (0.58) MMP13MMP2MMP1MMP3MMP9
SCHEMBL6694627 0.78 MMP13 (0.68) MMP13MMP2MMP1MMP3MMP9
SCHEMBL6697906 0.78 MMP13 (0.69) MMP13MMP2MMP1MMP3MMP9
SCHEMBL6690771 0.77 MMP13 (1.00) MMP13MMP2MMP1MMP3MMP9
SCHEMBL6693840 0.76 MMP13 (0.81) MMP13MMP2MMP1MMP3MMP9
SCHEMBL7673136 0.75 MMP13 (0.80) MMP13MMP2MMP1MMP3MMP9

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
US-6458822-B2 (4R)-1-(4-(4-FLUOROPHENOXY)BENZYL)-2-OXO-IMIDAZOLIDINE-4 -CARBOXYLIC ACID HYDROXYAMIDE, FOR EXAMPLE; TREATING VARIOUS DISEASES INCLUDING OSTEOARTHRITIS, RHEUMATOID ARTHRITIS, CANCER, OSTEOPOROSIS, STROKES PFIZER INC. 2002-10-01 US disclosed