SCHEMBL8060092

SCHEMBL8060092

O=C(O)C(CCc1cc2ccccc2[nH]1)CP(=O)(O)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 4/20 0.43
MMP13 P45452 4/20 0.43
MMP2 P08253 4/20 0.43
MMP1 P03956 3/20 0.43
MMP8 P22894 2/20 0.43
MMP12 P39900 2/20 0.43
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43

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
SCHEMBL5053273 0.88 ADAMTS4 (0.45)
SCHEMBL5053089 0.83 GRM3 (0.50)
SCHEMBL7607893 0.81 GRM3 (0.48)
SCHEMBL5134279 0.80 MMP13 (0.60) MMP3MMP13MMP2MMP1MMP8
SCHEMBL7608852 0.79 MMP13 (0.49) MMP3MMP13MMP2MMP1MMP8
SCHEMBL7607361 0.76 IDO1 (0.43)
SCHEMBL7609383 0.75 MMP13 (0.48) MMP3MMP13MMP2MMP1MMP8
SCHEMBL5054484 0.75 ANPEP (0.48)
SCHEMBL5058107 0.74 CYP1A2 (0.61)
SCHEMBL5057879 0.74 ADAMTS4 (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1005348-A1 NAALADASE COMPOSITIONS AND METHODS FOR TREATING GLUTAMATE ABNORMALITY AND EFFECTING NEURONAL ACTIVITY IN ANIMALS GUILFORD PHARMACEUTICALS INC. (US) 2000-06-07 EP disclosed
WO-1998013046-A1 NAALADASE COMPOSITIONS AND METHODS FOR TREATING GLUTAMATE ABNORMALITY AND EFFECTING NEURONAL ACTIVITY IN ANIMALS GUILFORD PHARMACEUTICALS INC. (US) 1998-04-02 WO disclosed