SCHEMBL29953498

SCHEMBL29953498

CC(C)(C)OC(=O)C(N)c1cc(B(O)O)ccn1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PLG P00747 1/20 0.32
▸ F12 P00748 1/20 0.32
▸ F11 P03951 1/20 0.32
▸ KLKB1 P03952 1/20 0.32
▸ PRSS1 P07477 1/20 0.32
▸ PRSS2 P07478 1/20 0.32
▸ PRSS3 P35030 1/20 0.32

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
SCHEMBL2724783 0.80 LMNA (0.40) LMNAKMT2A
SCHEMBL1244717 0.80 GABRP (0.44) LMNAKMT2A
SCHEMBL27911015 0.76 KMT2A (0.43) LMNAKMT2A
SCHEMBL2723305 0.74 APP (0.36) LMNAKMT2A
SCHEMBL24386890 0.73 SSTR4 (0.32) —
SCHEMBL7224834 0.73 KDM4E (0.40) —
SCHEMBL29102890 0.73 SSTR4 (0.32) —
SCHEMBL27572185 0.72 LOXL2 (0.39) LMNAKMT2A
SCHEMBL31197968 0.70 PRKCI (0.32) LMNA
SCHEMBL613810 0.70 MAPT (0.36) LMNAKMT2A

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
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