SCHEMBL7598917

SCHEMBL7598917

CCOC(=O)[C@H](C)N(C(=O)C(Cc1ccccc1)CP(=O)(OC)C(N)C(=O)OCc1ccccc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.37
GPR88 Q9GZN0 1/20 0.36
MME P08473 2/20 0.35
ANPEP P15144 2/20 0.35
HPRT1 P00492 1/20 0.35
F10 P00742 2/20 0.35
PRSS1 P07477 2/20 0.35
ACE2 Q9BYF1 1/20 0.35
F2 P00734 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ECE1 P42892 1/20 0.34

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
SCHEMBL7600399 0.85 HSD17B10 (0.40) HSD17B10GPR88MMEANPEPF10
SCHEMBL7599732 0.84 F10 (0.35) GPR88F10PRSS1F2
SCHEMBL7598920 0.83 HSD17B10 (0.49) HSD17B10MMEACE2ECE1
SCHEMBL8639837 0.74 GPR88 (0.37) GPR88F10PRSS1F2MEN1
SCHEMBL7598876 0.74 ACE2 (0.44) HSD17B10MMEACE2ECE1
SCHEMBL7314595 0.74 PPARA (0.44) GPR88MMEANPEPF10PRSS1
SCHEMBL7596669 0.73 KYNU (0.45) HSD17B10MMEACE2ECE1
SCHEMBL7598864 0.73 HSD17B10 (0.53) HSD17B10MMEACE2ECE1
SCHEMBL7600401 0.69 HSD17B10 (0.51) HSD17B10
SCHEMBL7598936 0.69 HSD17B10 (0.49) HSD17B10MMEACE2MEN1KMT2A

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