SCHEMBL7301104

SCHEMBL7301104

CCOC(=O)CCc1ccc(C(=N)NC(=O)OCc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 2/20 0.49
CYP4F2 P78329 1/20 0.49
CYP4A11 Q02928 1/20 0.49
TDP1 Q9NUW8 1/20 0.47
EPHX2 P34913 1/20 0.46
F2 P00734 2/20 0.46
MASP2 O00187 2/20 0.44
MAPT P10636 1/20 0.44
CYP4Z1 Q86W10 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
KLK8 O60259 1/20 0.43
F10 P00742 1/20 0.43
PLG P00747 1/20 0.43
PLAU P00749 1/20 0.43
PLAT P00750 1/20 0.43
KLK1 P06870 1/20 0.43
KLK2 P20151 1/20 0.43
KLK4 Q9Y5K2 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
SCHEMBL7303792 0.92 ALOX5 (0.48) CASP1CYP4F2CYP4A11TDP1F2
SCHEMBL2771639 0.88 ALDH1A1 (0.52) CASP1F2MASP2MAPTCYP4Z1
SCHEMBL7302595 0.87 FFAR1 (0.52) CASP1F2KLK8F10PLG
SCHEMBL7294390 0.84 LTA4H (0.53) TDP1MAPT
SCHEMBL14161303 0.84 MAPT (0.54) TDP1F2MASP2MAPTALDH1A1
SCHEMBL7293967 0.84 LTA4H (0.54) MAPT
SCHEMBL7295145 0.83 LTA4H (0.53) MAPT
SCHEMBL7296429 0.83 LTA4H (0.53) MAPT
SCHEMBL8363489 0.82 NPC1 (0.50) TDP1MASP2MAPTALDH1A1
Hydrochloric Acid SCHEMBL15251794 0.81 PLAU (0.48) F2MASP2KLK8F10PLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5574016-A Peptide compound and a process for the preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-12 US disclosed
EP-0513675-B1 New peptide compound and a process for the preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1996-09-11 EP disclosed
EP-0513675-A1 New peptide compound and a process for the preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-11-19 EP disclosed