SCHEMBL21229634

SCHEMBL21229634

C=N/C(=C\C(C)=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.43
▸ POLB P06746 1/20 0.43
▸ CES2 O00748 3/20 0.42
▸ CES1 P23141 3/20 0.42
▸ AKT1 P31749 1/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ GLA P06280 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ NFE2L2 Q16236 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.38
▸ CA12 O43570 1/20 0.38

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
SCHEMBL22620625 0.82 MAPT (0.44) MAPTPOLBCES2CES1AKT1
SCHEMBL22036325 0.81 LMNA (0.36) MAPTPOLBCES2CES1AKT1
SCHEMBL22071895 0.81 LMNA (0.36) MAPTPOLBCES2CES1AKT1
SCHEMBL24884816 0.78 AKT1 (0.35) MAPTCES2CES1AKT1ALDH1A1
SCHEMBL10304521 0.77 NFE2L2 (0.64) MAPTPOLBCES2CES1AKT1
SCHEMBL668443 0.77 NFE2L2 (0.64) MAPTPOLBCES2CES1AKT1
SCHEMBL11498687 0.77 NFE2L2 (0.64) MAPTPOLBCES2CES1AKT1
SCHEMBL19300441 0.77 AKT1 (0.38) MAPTCES2CES1AKT1ALDH1A1
SCHEMBL20625867 0.77 MEN1 (0.32) AKT1MEN1KMT2ALMNAL3MBTL1
SCHEMBL20908860 0.76 MEN1 (0.32) AKT1MEN1KMT2ALMNAL3MBTL1

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
WO-2019150119-A1 4-HYDROXYPIPERIDINE DERIVATIVES AND THEIR USE AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) ALMAC DISCOVERY LIMITED (GB) 2019-08-08 — — WO disclosed
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