SCHEMBL8099617

SCHEMBL8099617

CC(C)Oc1ccc(C(=O)CCCC(N)=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 1/20 0.62
▸ MAPT P10636 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ TP53 P04637 1/20 0.56
▸ THRB P10828 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ KMT2A Q03164 1/20 0.54
▸ NPC1 O15118 3/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ PDE4B Q07343 1/20 0.51
▸ GLA P06280 1/20 0.49
▸ STS P08842 5/20 0.47
▸ POLB P06746 1/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.44
▸ HDAC8 Q9BY41 2/20 0.43
▸ HDAC1 Q13547 2/20 0.43

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
SCHEMBL19043416 0.97 PARP10 (0.62) PARP10MAPTALDH1A1TP53THRB
SCHEMBL17937297 0.95 PARP10 (0.60) PARP10MAPTALDH1A1TP53THRB
SCHEMBL19043215 0.87 PARP10 (0.57) PARP10MAPTALDH1A1TP53THRB
SCHEMBL3089332 0.87 PDE4B (0.69) PARP10MAPTALDH1A1TP53THRB
SCHEMBL7925884 0.85 STS (0.59) PARP10MAPTALDH1A1TP53THRB
SCHEMBL13492946 0.84 ALDH1A1 (0.56) PARP10MAPTALDH1A1TP53THRB
SCHEMBL27663748 0.84 HSD17B3 (0.60) PARP10MAPTALDH1A1TP53THRB
SCHEMBL20382500 0.83 HTT (0.51) PARP10MAPTALDH1A1TP53THRB
SCHEMBL3023195 0.83 TP53 (0.55) PARP10MAPTALDH1A1TP53THRB
SCHEMBL7995333 0.81 PDE4B (0.75) PARP10MAPTKMT2ANPC1L3MBTL1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2550965-B1 Ceramide derivatives for treating polycystic kidney disease GENZYME CORP (US) 2019-01-16 — — EP disclosed
EP-2209473-B1 METHOD OF TREATING POLYCYSTIC KIDNEY DISEASES WITH CERAMIDE DERIVATIVES GENZYME CORP (US) 2017-11-22 — — EP disclosed
EP-2320886-B1 GLUCOSYLCERAMIDE SYNTHASE INHIBITION FOR THE TREATMENT OF COLLAPSING GLOMERULOPATHY AND OTHER GLOMERULAR DISEASE GENZYME CORP (US) 2017-06-28 — — EP disclosed
EP-3078373-A1 2-ACYLAMINOPROPANOL-TYPE GLUCOSYLCERAMIDE SYNTHASE INHIBITOR Genzyme Corporation (US) 2016-10-12 — — EP disclosed
EP-2550965-A2 Ceramide derivatives for treating polycystic kidney disease GENZYME CORPORATION (US) 2013-01-30 — — EP disclosed
WO-2008150486-A2 2-ACYLAMINOPROPOANOL-TYPE GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2008-12-11 — — WO disclosed
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