SCHEMBL7857783

SCHEMBL7857783

CC(C)[C@@H](NC(=O)[C@H](N)CCCN)C(=O)Oc1ccc2ccccc2c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 4/20 0.43
ERAP2 Q6P179 3/20 0.43
RECQL P46063 1/20 0.41
POLB P06746 1/20 0.40
APOBEC3A P31941 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
LTA4H P09960 1/20 0.40
SSTR5 P35346 2/20 0.39
GLA P06280 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
ERAP1 Q9NZ08 1/20 0.38

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
SCHEMBL7857074 0.82 ADAMTS4 (0.38) LNPEPERAP2LTA4HDPP4DPP8
SCHEMBL7860804 0.81 MMP2 (0.47) LTA4H
SCHEMBL7850357 0.78 MMP2 (0.51) LNPEPERAP2LTA4HERAP1
SCHEMBL7859103 0.78 LNPEP (0.52) LNPEPERAP2LTA4HERAP1
Trifluoroacetic Acid SCHEMBL7860786 0.77 KDM4E (0.43) KMT2ALTA4H
SCHEMBL27518599 0.77 METAP2 (0.55) POLBKMT2ATDP1
SCHEMBL27518604 0.77 METAP2 (0.55) POLBKMT2ATDP1
SCHEMBL7860762 0.77 LNPEP (0.47) LNPEPERAP2ERAP1
SCHEMBL7024530 0.74 METAP2 (0.54) KMT2ALTA4HTDP1DPP8DPP9
Trifluoroacetic Acid SCHEMBL7859146 0.74 LNPEP (0.48) LNPEPERAP2LTA4HERAP1

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
US-6245746-B1 ADMINISTERING AMIDE MICROBIOCIDE ANTIBIOTIC MICROCIDE PHARMACEUTICALS, INC. 2001-06-12 US disclosed
WO-1999037667-A1 EFFLUX PUMP INHIBITORS MICROCIDE PHARMACEUTICALS, INC. (US) 1999-07-29 WO disclosed