SCHEMBL28048827

SCHEMBL28048827

O=COc1c2ccccc2nn1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 12/20 0.40
▸ ATM Q13315 1/20 0.36
▸ MEN1 O00255 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ERN1 O75460 1/20 0.33
▸ F2 P00734 1/20 0.32
▸ PLAU P00749 1/20 0.32
▸ ELANE P08246 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
SCHEMBL25273272 0.76 ERN1 (0.38) MEN1KMT2AERN1ELANE
SCHEMBL28048850 0.72 ELANE (0.40) F2PLAUELANE
SCHEMBL11752400 0.71 LMNA (0.41) MEN1HTTKMT2AELANE
SCHEMBL27092032 0.65 POLB (0.55) ATMHTTKMT2AERN1
SCHEMBL5331216 0.62 ELANE (0.43) F2PLAUELANE
SCHEMBL15968524 0.62 MEN1 (0.40) MEN1KMT2A
SCHEMBL27745442 0.61 ATM (0.44) MPOATM
SCHEMBL8682362 0.61 KMT2A (0.43) MPOMEN1HTTKMT2AF2
SCHEMBL7005408 0.60 ALDH1A1 (0.38) MEN1KMT2A
SCHEMBL127188 0.60 ELANE (0.43) ATMKMT2AELANE

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
CN-105188696-A Gamma-diketones as WNT/beta -catenin signaling pathway activators SAMUMED LLC 2015-12-23 — — CN disclosed
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