SCHEMBL7855614

SCHEMBL7855614

CC(C)(C)OC(=O)N1CCC[C@@H]1[C]=O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.49
HPGD P15428 1/20 0.45
CTSK P43235 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL2355780 1.00 HSD17B10 (0.49) HSD17B10HPGDCTSKSMN1; SMN2NPC1
SCHEMBL5171011 1.00 HSD17B10 (0.49) HSD17B10HPGDCTSKSMN1; SMN2NPC1
SCHEMBL9555116 0.95 HPGD (0.48) HSD17B10HPGDCTSKSMN1; SMN2NPC1
SCHEMBL7380781 0.95 HPGD (0.48) HSD17B10HPGDCTSKSMN1; SMN2NPC1
SCHEMBL9554546 0.90 CTSK (0.42) HSD17B10HPGDCTSKSMN1; SMN2ALDH1A1
SCHEMBL10512917 0.87 HSD17B10 (0.47) HSD17B10HPGDCTSKSMN1; SMN2NPC1
SCHEMBL889059 0.85 HSD17B10 (0.55) HSD17B10HPGDCTSKSMN1; SMN2NPC1
SCHEMBL231219 0.85 HSD17B10 (0.55) HSD17B10HPGDCTSKSMN1; SMN2NPC1
SCHEMBL240005 0.85 DPP4 (0.56) HSD17B10CTSK
SCHEMBL1357066 0.85 DPP4 (0.56) HSD17B10CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111562720-B Photo-sensitized chemically amplified resist material, pattern forming method, semiconductor device, mask for lithography, and template for nanoimprint 东京毅力科创株式会社 2023-09-29 CN disclosed
EP-1144403-A1 SUBSTITUED PYRAZOLES AS P38 KINASE INHIBITORS G.D. SEARLE & CO. (US) 2001-10-17 EP disclosed
WO-2000031063-A1 SUBSTITUTED PYRAZOLES AS p38 KINASE INHIBITORS G.D. SEARLE & CO. (US) 2000-06-02 WO disclosed