SCHEMBL2355780

SCHEMBL2355780

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
SCHEMBL7855614 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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2536714-A2 A NOVEL 5-MEMBERED HETEROCYCLE DERIVATIVES AND MANUFACTURING PROCESS THEREOF Il-Dong Pharm. Co., Ltd. (KR) 2012-12-26 EP claimed
US-20120309750-A1 5-MEMBERED HETEROCYCLE DERIVATIVES AND MANUFACTURING PROCESS THEREOF ILDONG PHARM CO., LTD. (KR) 2012-12-06 US claimed
WO-2011102660-A2 A NOVEL 5-MEMBERED HETEROCYCLE DERIVATIVES AND MANUFACTURING PROCESS THEREOF ILDONG PHARM CO., LTD. (KR) 2011-08-25 WO claimed
EP-1021424-B1 THIADIAZOLE AMIDE MMP INHIBITORS UPJOHN CO (US) 2003-02-26 EP claimed
EP-0973517-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2002-07-24 EP claimed
US-6288105-B1 COMPOUNDS SUCH AS (S)-2-(4-((2-AMINO-3-HYDROXY-1-OXOPROPYL)AMINO)PHENYL)-6-HYDRO XY-3-(3-METHOXY-4-(1-PYRROLIDINYLMETHYL)BENZYL)BENZO(B)THIOPHE NE ELI LILLY AND COMPANY 2001-09-11 US claimed
EP-1021424-A1 THIADIAZOLE AMIDE MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2000-07-26 EP claimed
EP-0973517-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-01-26 EP claimed
WO-1998048794-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 WO claimed
WO-1997048688-A1 THIADIAZOLE AMIDE MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1997-12-24 WO claimed
US-4760061-A Antioestrogenic agent IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-07-26 US claimed
CN-106188175-B Treatment of klebsiella pneumoniae infections with antibacterial aminoglycoside compounds 轩竹(北京)医药科技有限公司 2020-08-11 CN disclosed
CN-105218632-A As peptide or plan peptide, the Preparation Method And The Use of transglutaminase inhibitor ZEDIRA GMBH 2016-01-06 CN disclosed
EP-2536714-A2 A NOVEL 5-MEMBERED HETEROCYCLE DERIVATIVES AND MANUFACTURING PROCESS THEREOF Il-Dong Pharm. Co., Ltd. (KR) 2012-12-26 EP disclosed
US-20120309750-A1 5-MEMBERED HETEROCYCLE DERIVATIVES AND MANUFACTURING PROCESS THEREOF ILDONG PHARM CO., LTD. (KR) 2012-12-06 US disclosed
EP-0145768-A1 CYCLIC PENTAPEPTIDES DISPLAYING SOMATOSTATIN ANTAGONISM AND METHOD OF TREATMENT OF MAMMALS THEREWITH COY, David Howard (US) 1985-06-26 EP disclosed
US-4505897-A INCREASING RELEASE OF GROWTH HORMONE, INSULIN, AND GLUCAGON THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 1985-03-19 US disclosed
WO-1984004916-A1 CYCLIC PENTAPEPTIDES DISPLAYING SOMATOSTATIN ANTAGONISM AND METHOD OF TREATMENT OF MAMMALS THEREWITH COY DAVID HOWARD (US) 1984-12-20 WO disclosed
EP-0127899-A1 Cyclic pentapeptides displaying somatostatin antagonism and method of treatment of mammals therewith The Administrators of The Tulane University Educational Fund (US) 1984-12-12 EP disclosed
EP-0034260-B1 PEPTIDES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS OR DIAGNOSTIC AGENTS CONTAINING THEM RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1983-07-20 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120309750-A1 5-MEMBERED HETEROCYCLE DERIVATIVES AND MANUFACTURING PROCESS THEREOF CYP3A5, UGT2B7, UGT1A7 HSD17B10 303/4885HPGD 90/4885CTSK 1789/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.