SCHEMBL7329474

SCHEMBL7329474

CC(C)CC(N[C@H](CCc1ccccc1)P(=O)(OCc1ccccc1)OCc1ccccc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSL P07711 5/20 0.46
CPA1 P15085 2/20 0.45
CPA2 P48052 2/20 0.45
CPA4 Q9UI42 2/20 0.45
MME P08473 1/20 0.45
ECE1 P42892 1/20 0.45
MMP3 P08254 3/20 0.44
MMP1 P03956 2/20 0.44
MEN1 O00255 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CTSB P07858 1/20 0.44
MMP2 P08253 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
SCHEMBL7309259 1.00 CTSL (0.46) CTSLCPA1CPA2CPA4MME
SCHEMBL7309270 1.00 CTSL (0.46) CTSLCPA1CPA2CPA4MME
SCHEMBL7315045 0.92 CPA1 (0.45) CTSLCPA1CPA2CPA4MME
SCHEMBL7315037 0.92 CPA1 (0.45) CTSLCPA1CPA2CPA4MME
SCHEMBL7305566 0.92 CPA1 (0.45) CTSLCPA1CPA2CPA4MME
SCHEMBL7317922 0.91 MMP1 (0.47) CTSLMMP3MMP1MEN1KMT2A
SCHEMBL7316369 0.88 CTSK (0.46) MMEECE1
SCHEMBL7323956 0.88 CTSK (0.46) MMEECE1
SCHEMBL7383267 0.88 CTSK (0.46) MMEECE1
SCHEMBL7314091 0.88 CTSK (0.46) MMEECE1

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-0612324-A1 PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1994-08-31 EP disclosed
WO-1993009136-A1 PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1993-05-13 WO disclosed