SCHEMBL7213193

SCHEMBL7213193

NC(=O)CC[C@@H]([C]=O)NO

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
KMT2A Q03164 1/20 0.40
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
BMP1 P13497 1/20 0.33

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
SCHEMBL1647741 0.81 ALOX15 (0.39) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL3392906 0.81 ALOX15 (0.39) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL7352206 0.78 DPP4 (0.38) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL11363514 0.78 DPP4 (0.38) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL2246172 0.76 CTSC (0.37) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL2246163 0.76 CTSC (0.37) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL77561 0.75 DPP8 (0.54) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL77560 0.75 DPP8 (0.54) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL21724570 0.74 CTSD (0.39) ALOX15BLMPMP22KMT2ADPP4
SCHEMBL10728037 0.71 DPP4 (0.43) ALOX15BLMPMP22KMT2ADPP4

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-6613738-B1 Comprising 1,2-dihydroxy-homotyrosine, 4-hydroxyproline, threonine, glutamine, 3-,4-dihydroxymethylproline, 4,5-dihydroxyornithine and lipid HMV CORPORATION 2003-09-02 US disclosed
WO-2000009735-A1 A CYCLIC LIPOPEPTIDE FROM CRYPTOSPORIOPSIS QUERCINA POSSESSING ANTIFUNGAL ACTIVITY STROBEL GARY A (US) 2000-02-24 WO disclosed