SCHEMBL3199170

SCHEMBL3199170

CC(C)(C)OC(=O)N1CSC[C@H]1C=O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.39
HSD17B10 Q99714 2/20 0.37
NR1H2 P55055 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
PREP P48147 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
CTSK P43235 1/20 0.33
USP2 O75604 1/20 0.33

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
SCHEMBL5307200 1.00 ATM (0.39) ATMHSD17B10NR1H2CHRM2CHRM1
SCHEMBL16857528 1.00 ATM (0.39) ATMHSD17B10NR1H2CHRM2CHRM1
SCHEMBL6897583 0.84 PREP (0.38) HSD17B10NR1H2CHRM2CHRM1CHRM3
SCHEMBL6897589 0.84 PREP (0.38) HSD17B10NR1H2CHRM2CHRM1CHRM3
SCHEMBL4843577 0.78 ATM (0.36) ATMHSD17B10NR1H2CHRM2CHRM1
SCHEMBL14209894 0.78 ATM (0.39) ATMHSD17B10NR1H2CHRM2CHRM1
SCHEMBL12203690 0.78 ATM (0.39) ATMHSD17B10NR1H2CHRM2CHRM1
SCHEMBL27538723 0.78 ATM (0.39) ATMHSD17B10NR1H2CHRM2CHRM1
SCHEMBL2277430 0.78 NR1H2 (0.44) HSD17B10NR1H2CHRM2CHRM1CHRM3
SCHEMBL7914485 0.77 NR1H2 (0.42) ATMHSD17B10NR1H2CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7666866-B2 Antithrombotic diamides ELI LILLY AND COMPANY (US) 2010-02-23 US claimed
EP-1819693-B1 ANTITHROMBOTIC DIAMIDES LILLY CO ELI (US) 2009-08-26 EP claimed
US-20090062271-A1 Antithrombotic Diamides ELI LILLY AND COMPANY (US) 2009-03-05 US claimed
EP-1819693-A1 ANTITHROMBOTIC DIAMIDES ELI LILLY AND COMPANY (US) 2007-08-22 EP claimed
WO-2006057868-A1 ANTITHROMBOTIC DIAMIDES ELI LILLY AND COMPANY (US) 2006-06-01 WO claimed
US-9278996-B2 Dolastatin-10 derivative, method of producing the same and anticancer drug composition containing the same CELLTRION, INC. (KR) 2016-03-08 US disclosed
US-9278996-B2 Dolastatin-10 derivative, method of producing the same and anticancer drug composition containing the same CELLTRION, INC. (KR) 2016-03-08 US disclosed
US-20150225455-A1 DOLASTATIN-10 DERIVATIVE, METHOD OF PRODUCING THE SAME AND ANTICANCER DRUG COMPOSITION CONTAINING THE SAME CELLTRION, INC. (KR) 2015-08-13 US disclosed
US-20150225455-A1 DOLASTATIN-10 DERIVATIVE, METHOD OF PRODUCING THE SAME AND ANTICANCER DRUG COMPOSITION CONTAINING THE SAME CELLTRION, INC. (KR) 2015-08-13 US disclosed
US-7666866-B2 Antithrombotic diamides ELI LILLY AND COMPANY (US) 2010-02-23 US disclosed
EP-1819693-B1 ANTITHROMBOTIC DIAMIDES LILLY CO ELI (US) 2009-08-26 EP disclosed
US-20090062271-A1 Antithrombotic Diamides ELI LILLY AND COMPANY (US) 2009-03-05 US disclosed
US-20030232806-A1 Amino acid derivatives and pharmaceutical composition comprising, as active ingredients, them ONO PHARMACEUTICAL CO., LTD. 2003-12-18 US disclosed
US-6605608-B1 Such as n-(1-benzylpiperidin-4-yl)-3-cyclohexylmethylthio-2-((4R)-3-t -butoxycarbonylthiazolidin-4-ylcarbonylamino)propan-a mide; n-type calcium channel inhibitors ONO PHARMACEUTICAL CO., LTD (JP) 2003-08-12 US disclosed
US-20030013725-A1 Amino acid derivatives ONO PHARMACEUTICAL CO., LTD. 2003-01-16 US disclosed
US-6310095-B1 INHIBITING OR TREATING CANCER, TREATING INTIMAL HYPERPLASIA ASSOCIATED WITH RESTENOSIS AND ATHEROSCLEROSIS, INHIBITING POST-TRANSLATIONAL MODIFICATION OF ONCOGENIC RAS PROTEIN BY PROTEIN FARNESYLTRANSFERASE AND/OR GERANYLGERANYLTRANSFERASE UNIVERSITY OF PITTSBURGH 2001-10-30 US disclosed
EP-1090912-A1 AMINO ACID DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-04-11 EP disclosed
EP-0997147-A1 AMINO ACID DERIVATIVES Ono Pharmaceutical Co., Ltd. (JP) 2000-05-03 EP disclosed
EP-0986384-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 2000-03-22 EP disclosed
WO-1998050029-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1998-11-12 WO 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 (4 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-20150225455-A1 DOLASTATIN-10 DERIVATIVE, METHOD OF PRODUCING THE SAME AND ANTICANCER DRUG COMPOSITION CONTAINING THE SAME DAD1, DDOST, SCD5 ATM 3455/4885HSD17B10 127/4885NR1H2 258/4885
US-20090062271-A1 Antithrombotic Diamides TFPI, SERPINC1, TFPI2 ATM 3348/4885HSD17B10 1348/4885NR1H2 2516/4885
US-20030013725-A1 Amino acid derivatives CACNA1B, SCN1A, SCN2A ATM 3517/4885HSD17B10 1544/4885NR1H2 550/4885
US-20030232806-A1 Amino acid derivatives and pharmaceutical composition comprising, as active ingredients, them CACNA1I, CACNA1S, CACNA1B ATM 2618/4885HSD17B10 4741/4885NR1H2 4572/4885

“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.