SCHEMBL9068979

SCHEMBL9068979

COP(=O)(OC)C(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.60
ECE1 P42892 3/20 0.60
MAPT P10636 2/20 0.60
LMNA P02545 1/20 0.60
NMBR P28336 2/20 0.60
GAA P10253 1/20 0.59
HTT P42858 1/20 0.59
ACE P12821 2/20 0.57
MMP2 P08253 8/20 0.57
MMP9 P14780 8/20 0.57
MMP8 P22894 8/20 0.57
MMP14 P50281 8/20 0.57
MMP7 P09237 1/20 0.57
MMP11 P24347 2/20 0.55
SSTR1 P30872 1/20 0.55
ANPEP P15144 1/20 0.55
ERAP1 Q9NZ08 1/20 0.55

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
SCHEMBL7391501 0.91 MME (0.62) MMEECE1MAPTLMNANMBR
SCHEMBL6841178 0.84 NMBR (0.70) MMEECE1MAPTLMNANMBR
SCHEMBL12203727 0.84 NMBR (0.70) MMEECE1MAPTLMNANMBR
SCHEMBL29401413 0.83 NMBR (0.73) MAPTLMNANMBRGAAHTT
SCHEMBL17319524 0.83 NMBR (0.73) MAPTLMNANMBRGAAHTT
SCHEMBL1318661 0.83 NMBR (0.73) MAPTLMNANMBRGAAHTT
SCHEMBL7397132 0.82 F2 (0.65) MMEECE1
SCHEMBL7398288 0.81 MMP2 (0.61) MMEECE1NMBRMMP2MMP9
SCHEMBL13073927 0.81 NMBR (0.64) MMEECE1MAPTLMNANMBR
SCHEMBL3808330 0.81 NMBR (0.76) MMEECE1MAPTLMNANMBR

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
US-5504070-A ADMINISTERING OLIGOPEPTIDES, PHOSPHONATES AND MODIFIED AMINO ACIDS AS INHIBITORS BERLEX LABORATORIES, INC. (US) 1996-04-02 US disclosed