SCHEMBL24114487

SCHEMBL24114487

CC(CC=O)NC(=O)CCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ HDAC2 Q92769 1/20 0.51
▸ HDAC8 Q9BY41 1/20 0.51
▸ HDAC6 Q9UBN7 1/20 0.51
▸ POLB P06746 2/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ RAB9A P51151 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL18759290 1.00 SMN1; SMN2 (0.58) SMN1; SMN2HDAC2HDAC8HDAC6POLB
SCHEMBL3456224 0.83 RAB9A (0.67) SMN1; SMN2HDAC2HDAC8HDAC6POLB
SCHEMBL22331980 0.83 RAB9A (0.67) SMN1; SMN2HDAC2HDAC8HDAC6POLB
SCHEMBL5612230 0.83 SMN1; SMN2 (0.63) SMN1; SMN2HDAC2HDAC8HDAC6POLB
SCHEMBL19791859 0.81 HDAC2 (0.54) SMN1; SMN2HDAC2HDAC8HDAC6MEN1
SCHEMBL24465200 0.81 SMN1; SMN2 (0.45) SMN1; SMN2HDAC2HDAC8HDAC6MEN1
SCHEMBL7772333 0.80 ALDH1A1 (0.66) SMN1; SMN2HDAC2HDAC8HDAC6RAB9A
SCHEMBL16908173 0.79 MMP2 (0.49) HDAC2HDAC8HDAC6HTTALDH1A1
SCHEMBL7300117 0.79 HDAC2 (0.51) SMN1; SMN2HDAC2HDAC8HDAC6MEN1
SCHEMBL8091558 0.78 SIGMAR1 (0.57) SMN1; SMN2HDAC2HDAC8HDAC6POLB

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
EP-3362754-B1 PROTEASOME INHIBITORS AND USES THEREOF UNIV CORNELL (US) 2021-12-22 — — EP disclosed
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