SCHEMBL216322

SCHEMBL216322

CC(C)(C)OC(=O)N1CCC[C@H](S)C1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
MAPT P10636 1/20 0.55
KMT2A Q03164 1/20 0.55
HPGD P15428 1/20 0.53
EPHX1 P07099 1/20 0.47
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PREP P48147 2/20 0.44
USP30 Q70CQ3 1/20 0.44
RECQL P46063 1/20 0.43
NR1H2 P55055 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ACKR3 P25106 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
GLS O94925 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
SCHEMBL1065990 1.00 MEN1 (0.55) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL2230223 1.00 MEN1 (0.55) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL1334464 0.90 HPGD (0.51) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL1334462 0.90 HPGD (0.51) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL1335011 0.90 HPGD (0.51) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL25513795 0.87 HPGD (0.60) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL2927661 0.87 HPGD (0.60) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL18549298 0.82 NR1H2 (0.54) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL970631 0.82 NR1H2 (0.54) MEN1ALDH1A1MAPTKMT2AHPGD
SCHEMBL12908 0.81 ALDH1A1 (0.56) MEN1ALDH1A1MAPTKMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11351168-B1 2,4-disubstituted pyrimidines useful as kinase inhibitors CELGENE CAR LLC (BM) 2022-06-07 US disclosed
CN-107033097-B Oxadiazole derivative, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2022-02-08 CN disclosed
US-10828300-B2 Substituted 2,4-diaminopyrimidines as kinase inhibitors CELGENE CAR LLC (BM) 2020-11-10 US disclosed
US-10596172-B2 2,4-disubstituted pyrimidines useful as kinase inhibitors CELGENE CAR LLC (BM) 2020-03-24 US disclosed
EP-3549934-A1 HETEROARYL COMPOUNDS AND USES THEREOF Celgene CAR LLC (BM) 2019-10-09 EP disclosed
US-20190192512-A1 HETEROARYL COMPOUNDS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2019-06-27 US disclosed
US-20190117650-A1 HETEROARYL COMPOUNDS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2019-04-25 US disclosed
EP-2519235-B1 HETEROARYL COMPOUNDS AND USES THEREOF CELGENE CAR LLC (BM) 2018-11-21 EP disclosed
EP-2361248-B1 HETEROARYL COMPOUNDS AND USES THEREOF CELGENE CAR LLC (BM) 2018-09-19 EP disclosed
US-10010548-B2 2,4-disubstituted pyrimidines useful as kinase inhibitors CELGENE CAR LLC (BM) 2018-07-03 US disclosed
EP-1875903-B1 TUBERCULOSIS TREATMENT USING PLEUROMUTILIN DERIVATIVES NABRIVA THERAPEUTICS AG (AT) 2010-07-28 EP disclosed
US-20100029610-A1 Heteroaryl Compounds and Uses Thereof AVILA THERAPEUTICS, INC. (US) 2010-02-04 US disclosed
EP-1875903-A1 TUBERCULOSIS TREATMENT USING PLEUROMUTILIN DERIVATIVES Nabriva Therapeutics Forschungs GmbH (AT) 2008-01-09 EP disclosed
US-20070270404-A1 Tuberculosis treatment using pleuromutilin derivatives NABRIVA THERAPEUTICS FORSCHUNGS GMBH (AT) 2007-11-22 US disclosed
US-20050215637-A1 Tuberculosis treatment ASCHER GERD 2005-09-29 US disclosed
US-20050131023-A1 Use of pleuromutilins for the treatment of disorders caused by helicobacter pylori HONG KONG KING-FRIEND INDUSTRIAL COMPANY LTD. (CN) 2005-06-16 US disclosed
EP-1501495-A1 USE OF PLEUROMUTILINS FOR THE TREATMENT OF DISORDERS CAUSED BY HELICOBACTER PYLORI Sandoz AG (CH) 2005-02-02 EP disclosed
EP-1492518-A2 TUBERCULOSIS TREATMENT USING PLEUROMUTILIN DERIVATIVES Sandoz AG (CH) 2005-01-05 EP disclosed
WO-2003090740-A1 USE OF PLEUROMUTILINS FOR THE TREATMENT OF DISORDERS CAUSED BY HELICOBACTER PYLORI SANDOZ AG (CH) 2003-11-06 WO disclosed
WO-2003082260-A2 TUBERCULOSIS TREATMENT USING PLEUROMUTILIN DERIVATIVES SANDOZ AG (CH) 2003-10-09 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 (10 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-20100029610-A1 Heteroaryl Compounds and Uses Thereof ABCG2, CYP3A43, CYP3A5 MEN1 606/4885ALDH1A1 684/4885MAPT 1888/4885
US-20050131023-A1 Use of pleuromutilins for the treatment of disorders caused by helicobacter pylori FABP6, PLEC, UBQLN2 MEN1 626/4885ALDH1A1 979/4885MAPT 3998/4885
US-20050215637-A1 Tuberculosis treatment TTR, TST, TREH MEN1 1178/4885ALDH1A1 797/4885MAPT 1815/4885
US-11351168-B1 2,4-disubstituted pyrimidines useful as kinase inhibitors DCK, CDK2, DTYMK MEN1 3174/4885ALDH1A1 2583/4885MAPT 3269/4885
US-20190192512-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 MEN1 606/4885ALDH1A1 684/4885MAPT 1888/4885
US-20070270404-A1 Tuberculosis treatment using pleuromutilin derivatives PLEC, TTR, TREH MEN1 559/4885ALDH1A1 1152/4885MAPT 2123/4885
US-10010548-B2 2,4-disubstituted pyrimidines useful as kinase inhibitors DCK, CDK2, DTYMK MEN1 3174/4885ALDH1A1 2583/4885MAPT 3269/4885
US-10828300-B2 Substituted 2,4-diaminopyrimidines as kinase inhibitors ABL1, DCK, ERBB2 MEN1 3102/4885ALDH1A1 1989/4885MAPT 2723/4885
US-20190117650-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 MEN1 606/4885ALDH1A1 684/4885MAPT 1888/4885
US-10596172-B2 2,4-disubstituted pyrimidines useful as kinase inhibitors DCK, CDK2, DTYMK MEN1 3174/4885ALDH1A1 2583/4885MAPT 3269/4885

“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.