SCHEMBL3666873

SCHEMBL3666873

CCCCC1(c2ccc(O)cc2)C(=O)Nc2c1ccc(F)c2F.O=C1Nc2c(ccc(F)c2F)C1(c1ccc(O)cc1)C1CCCCC1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.30
MMP9 P14780 2/20 0.30
MMP3 P08254 1/20 0.30
CCR5 P51681 1/20 0.30

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
SCHEMBL3666040 0.87
SCHEMBL13145546 0.86 CNR1 (0.33) MMP2MMP9
SCHEMBL3084560 0.86 CNR1 (0.33) MMP2MMP9
SCHEMBL3092417 0.86 MMP2 (0.39) MMP2MMP9MMP3
SCHEMBL3082458 0.86 CNR1 (0.33) MMP2MMP9
SCHEMBL3072570 0.86 CNR1 (0.33) MMP2MMP9
SCHEMBL31003825 0.86 CNR1 (0.33) MMP2MMP9
SCHEMBL3088632 0.85 CNR1 (0.33) MMP2MMP9
SCHEMBL31003725 0.85 CNR1 (0.33) MMP2MMP9
SCHEMBL3093775 0.83 MMP2 (0.43) MMP2MMP9MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2139856-A1 SUBSTITUTED 3-(4-HYDROXYPHENYL)-INDOLIN-2-ONE-COMPOUNDS Topotarget A/S (DK) 2010-01-06 EP claimed
WO-2008129075-A1 SUBSTITUTED 3-(4-HYDROXYPHENYL)-INDOLIN-2-ONE-COMPOUNDS TOPOTARGET A/S (DK) 2008-10-30 WO claimed