SCHEMBL84795

SCHEMBL84795

CC(C)OC(=O)[C@H](N)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.48
TSHR P16473 1/20 0.43
DPP4 P27487 3/20 0.35
FAP Q12884 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
LAP3 P28838 1/20 0.35
HCAR2 Q8TDS4 1/20 0.34
CA12 O43570 5/20 0.33
CA1 P00915 5/20 0.33
CA2 P00918 5/20 0.33
CA9 Q16790 5/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CA7 P43166 3/20 0.31
CA14 Q9ULX7 3/20 0.31
LMNA P02545 2/20 0.31
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31

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
SCHEMBL769572 1.00 SLC7A5 (0.48) SLC7A5TSHRDPP4FAPDPP8
SCHEMBL769573 1.00 SLC7A5 (0.48) SLC7A5TSHRDPP4FAPDPP8
Hydrochloric Acid SCHEMBL1456828 0.97 SLC7A5 (0.46) SLC7A5TSHRDPP4FAPDPP8
Hydrochloric Acid SCHEMBL17099133 0.97 SLC7A5 (0.46) SLC7A5TSHRDPP4FAPDPP8
SCHEMBL11789453 0.84 TSHR (0.43) SLC7A5TSHRDPP4DPP7HCAR2
SCHEMBL28500308 0.84 TSHR (0.43) SLC7A5TSHRDPP4DPP7HCAR2
SCHEMBL11789459 0.84 TSHR (0.43) SLC7A5TSHRDPP4DPP7HCAR2
SCHEMBL145865 0.84 SLC7A5 (0.48) SLC7A5TSHRDPP4FAPDPP8
Hydrochloric Acid SCHEMBL18075532 0.82 TSHR (0.42) SLC7A5TSHRDPP4DPP7HCAR2
Hydrochloric Acid SCHEMBL18075258 0.82 TSHR (0.42) SLC7A5TSHRDPP4DPP7HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023214426-A1 PROCESS FOR THE PREPARATION OF R-OXYBUTYNIN HYDROCHLORIDE HARMAN FINOCHEM LIMITED (IN) 2023-11-09 WO disclosed
WO-2023088441-A1 KIF18A INHIBITOR 微境生物医药科技(上海)有限公司 2023-05-25 WO disclosed
WO-2022247770-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海璎黎药业有限公司 2022-12-01 WO disclosed
US-11033556-B2 Bicyclic sulfonamides ALIGOS THERAPEUTICS, INC. (US) 2021-06-15 US disclosed
US-20200345749-A1 BICYCLIC SULFONAMIDES ALIGOS THERAPEUTICS, INC. 2020-11-05 US disclosed
US-20200277321-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALAOGS THEREOF Janssen Pharmaceuticals, Inc. 2020-09-03 US disclosed
US-RE48171-E1 Substituted nucleosides, nucleotides and analogs thereof Janssen Biopharma, Inc. (US) 2020-08-25 US disclosed
US-10696708-B2 Substituted nucleosides, nucleotides and analogs thereof Janssen Biopharma, Inc. (US) 2020-06-30 US disclosed
US-10464965-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2019-11-05 US disclosed
US-10421771-B2 2019-09-24 US disclosed
US-20160096836-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2016-04-07 US disclosed
US-20150126505-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE AMBIT BIOSCIENCES CORP (US) 2015-05-07 US disclosed
US-8921546-B2 Imidazolothiazole compounds for the treatment of disease AMBIT BIOSCIENCES CORPORATION (US) 2014-12-30 US disclosed
US-20140243525-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE AMBIT BIOSCIENCES CORPORATION (US) 2014-08-28 US disclosed
US-8557810-B2 Imidazolothiazole compounds for the treatment of disease AMBIT BIOSCIENCES CORPORATION (US) 2013-10-15 US disclosed
US-20120129850-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE AMBIT BIOSCIENCES CORPORATION 2012-05-24 US disclosed
US-8129374-B2 Method of using imidazolothiazole compounds for the treatment of disease AMBIT BIOSCIENCE CORPORATION (US) 2012-03-06 US disclosed
US-20100298313-A1 METHOD OF USING IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE AMBIT BIOSCIENCES CORPORATION 2010-11-25 US disclosed
US-7820657-B2 receptor kinase inhibitors such as 3-(2-{4-[3-(5-tert-Butyl-isoxazol-3-yl)-ureido]-phenyl}-benzo[d]imidazo[2,1-b]thiazol-7-yl)-N-(2-morpholin-4-yl-ethyl)-propionamide; flk inhibitors AMBIT BIOSCIENCES CORPORATION (US) 2010-10-26 US disclosed
US-20070232604-A1 receptor kinase inhibitors such as 3-(2-{4-[3-(5-tert-Butyl-isoxazol-3-yl)-ureido]-phenyl}-benzo[d]imidazo[2,1-b]thiazol-7-yl)-N-(2-morpholin-4-yl-ethyl)-propionamide; flk inhibitors AMBIT BIOSCIENCES CORPORATION 2007-10-04 US 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 (12 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-20150126505-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE GRK2, GRK4, GRK3 SLC7A5 4173/4885TSHR 415/4885DPP4 1781/4885
US-10464965-B2 Substituted nucleosides, nucleotides and analogs thereof PNP, NT5C3B, ADAR SLC7A5 1251/4885TSHR 3355/4885DPP4 278/4885
US-20140243525-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE GRK2, GRK4, GRK3 SLC7A5 4173/4885TSHR 415/4885DPP4 1781/4885
US-20120129850-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE GRK2, GRK4, GRK3 SLC7A5 4173/4885TSHR 415/4885DPP4 1781/4885
US-20100298313-A1 METHOD OF USING IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE GRK2, GRK4, GRK5 SLC7A5 4688/4885TSHR 566/4885DPP4 1679/4885
US-10696708-B2 Substituted nucleosides, nucleotides and analogs thereof PNP, NT5C3B, NT5C2 SLC7A5 1502/4885TSHR 3730/4885DPP4 253/4885
US-20160096836-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A SLC7A5 323/4885TSHR 1218/4885DPP4 1542/4885
US-11033556-B2 Bicyclic sulfonamides STS, SULT2A1, ARSA SLC7A5 352/4885TSHR 1724/4885DPP4 1491/4885
US-20200345749-A1 BICYCLIC SULFONAMIDES STS, SULT2A1, ARSA SLC7A5 352/4885TSHR 1724/4885DPP4 1491/4885
US-20200277321-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALAOGS THEREOF PNP, RNGTT, NT5C3B SLC7A5 844/4885TSHR 3939/4885DPP4 491/4885
US-20070232604-A1 receptor kinase inhibitors such as 3-(2-{4-[3-(5-tert-Butyl-isoxazol-3-yl)-ureido]-phenyl}-benzo[d]imidazo[2,1-b]thiazol-7-yl)-N-(2-morpholin-4-yl-ethyl)-propionamide; flk inhibitors GRK2, GRK3, BLK SLC7A5 4768/4885TSHR 395/4885DPP4 1364/4885
US-10421771-B2 PNP, ADAR, NT5C2 SLC7A5 2425/4885TSHR 3846/4885DPP4 317/4885

“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.