SCHEMBL23809297

SCHEMBL23809297

CC(C)/C=C/CNC(=O)COCCOC(N)COc1cccc(C(=O)NCCNC(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ F10 P00742 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MAOB P27338 1/20 0.35
▸ NR1H4 Q96RI1 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ ADRB2 P07550 1/20 0.34
▸ ADRB1 P08588 1/20 0.34
▸ ADRB3 P13945 1/20 0.34
▸ PARP1 P09874 1/20 0.34

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
SCHEMBL24877169 0.93 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1GAAMAPTF10
SCHEMBL23106243 0.93 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1GAAMAPTF10
SCHEMBL23809335 0.91 ALDH1A1 (0.37) SMN1; SMN2ALDH1A1GAAMAPTF10
SCHEMBL23106232 0.88 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1GAAMAPTKMT2A
SCHEMBL23106236 0.86 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1GAAMAPTF10
SCHEMBL23879759 0.85 ALDH1A1 (0.37) SMN1; SMN2ALDH1A1GAAMAPTF10
SCHEMBL23879728 0.85 F10 (0.39) ALDH1A1GAAMAPTF10KMT2A
SCHEMBL22327072 0.85 MAOB (0.37) SMN1; SMN2ALDH1A1GAAMAPTF10
SCHEMBL23106278 0.84 ALDH1A1 (0.37) SMN1; SMN2ALDH1A1GAAMAPTF10
SCHEMBL23106219 0.83 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1GAAMAPTF10

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-20210284975-A1 MODIFIED PYROCOCCUS POLYMERASES AND USES THEREOF FIRST-CITIZENS BANK & TRUST COMPANY 2021-09-16 — — US disclosed
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