SCHEMBL7600399

SCHEMBL7600399

COC(=O)[C@H](C)N(C(=O)C(CC(C)C)CP(=O)(OC)C(N)C(=O)OCc1ccccc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.40
GPR88 Q9GZN0 1/20 0.39
KYNU Q16719 1/20 0.38
CTSK P43235 2/20 0.37
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CTSS P25774 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ACE2 Q9BYF1 1/20 0.37
F2 P00734 1/20 0.37
F10 P00742 1/20 0.37
PRSS1 P07477 1/20 0.37
ANPEP P15144 1/20 0.36
MME P08473 1/20 0.36
ECE1 P42892 1/20 0.36
MMP1 P03956 1/20 0.36

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
SCHEMBL8639837 0.89 GPR88 (0.37) GPR88CTSBMEN1KMT2AF2
SCHEMBL7596669 0.87 KYNU (0.45) HSD17B10KYNUCTSKCTSLCTSB
SCHEMBL7599732 0.86 F10 (0.35) GPR88KYNUF2F10PRSS1
SCHEMBL7598917 0.85 HSD17B10 (0.37) HSD17B10GPR88MEN1KMT2AACE2
SCHEMBL7600401 0.83 HSD17B10 (0.51) HSD17B10MMP1
SCHEMBL7598876 0.83 ACE2 (0.44) HSD17B10ACE2MMEECE1
SCHEMBL8752163 0.82 GPR88 (0.37) HSD17B10GPR88CTSBMEN1KMT2A
Hydrochloric Acid SCHEMBL6926940 0.81 GPR88 (0.37) HSD17B10GPR88CTSBF2F10
SCHEMBL8641877 0.79 GPR88 (0.36) HSD17B10GPR88ANPEPMMP1
SCHEMBL8641846 0.78 MMP3 (0.36) HSD17B10GPR88F2F10PRSS1

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-0832085-B1 PHOSPHINIC ACID DERIVATIVES WITH METALLOPEPTIDASE INHIBITORY ACTIVITY ZAMBON SPA (IT) 2002-12-18 EP disclosed
EP-0766687-B1 PHOSPHINIC ACID DERIVATIVES WITH METALLOPEPTIDASE INHIBITORY ACTIVITY ZAMBON SPA (IT) 1998-08-05 EP disclosed