SCHEMBL13920587

SCHEMBL13920587

CCOC(=O)[C@@H]1C[C@H](N=[N+]=[N-])CN1B(C)O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 2/20 0.46
▸ ANPEP P15144 2/20 0.46
▸ DPP7 Q9UHL4 5/20 0.34
▸ DPP8 Q6V1X1 4/20 0.34
▸ DPP9 Q86TI2 4/20 0.34
▸ DPP4 P27487 3/20 0.34
▸ FKBP1A P62942 2/20 0.31
▸ CAPN1 P07384 2/20 0.30

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
SCHEMBL13920584 1.00 MMP2 (0.46) MMP2ANPEPDPP7DPP8DPP9
SCHEMBL14367090 0.85 MMP2 (0.63) MMP2ANPEPDPP7DPP8DPP9
SCHEMBL14278562 0.78 MMP2 (0.56) MMP2ANPEPDPP7DPP8DPP9
SCHEMBL13920579 0.76 KMT2A (0.34) FKBP1A
SCHEMBL13920578 0.76 KMT2A (0.34) FKBP1A
SCHEMBL15221388 0.76 MMP2 (0.45) MMP2ANPEPDPP7DPP8DPP9
SCHEMBL13920585 0.75 MMP2 (0.39) MMP2ANPEPFKBP1A
SCHEMBL13920586 0.75 MMP2 (0.39) MMP2ANPEPFKBP1A
SCHEMBL15221350 0.74 MMP2 (0.43) MMP2ANPEPDPP7DPP8DPP9
SCHEMBL15221374 0.74 MMP2 (0.43) MMP2ANPEPDPP7DPP8DPP9

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-7511062-B2 Substituted 2-quinolyl-oxazoles useful as PDE4 inhibitors SCHERING CORPORATION (US) 2009-03-31 — — US disclosed
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