SCHEMBL3828565

SCHEMBL3828565

CC(C)(C)NC(=O)COCC(=O)NC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
LMNA P02545 5/20 0.46
MAPT P10636 3/20 0.46
POLB P06746 3/20 0.46
NPC1 O15118 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
HTT P42858 2/20 0.44
HPGD P15428 1/20 0.44
ALDH1A1 P00352 3/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL12674068 0.91 MAPT (0.45) TSHRLMNAMAPTPOLBNPC1
SCHEMBL23571957 0.89 TSHR (0.41) TSHRLMNAMAPTPOLBNPC1
SCHEMBL23109243 0.89 TSHR (0.41) TSHRLMNAMAPTPOLBNPC1
SCHEMBL2757959 0.88 TSHR (0.43) TSHRLMNAMAPTPOLBNPC1
SCHEMBL20953642 0.87 MAPT (0.44) TSHRLMNAMAPTPOLBNPC1
SCHEMBL19171885 0.87 TSHR (0.40) TSHRLMNAMAPTPOLBNPC1
SCHEMBL9126555 0.86 TSHR (0.42) TSHRLMNAMAPTPOLBNPC1
SCHEMBL23772908 0.85 TSHR (0.39) TSHRLMNAMAPTPOLBNPC1
SCHEMBL23109242 0.85 TSHR (0.39) TSHRLMNAMAPTPOLBNPC1
SCHEMBL12061928 0.85 MAPT (0.40) TSHRLMNAMAPTPOLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240209019-A1 COMPOUNDS AND METHODS FOR TREATING HYPERKALEMIA ARDELYX, INC. (US) 2024-06-27 US disclosed
US-20240209019-A1 COMPOUNDS AND METHODS FOR TREATING HYPERKALEMIA ARDELYX, INC. (US) 2024-06-27 US disclosed
US-11858959-B2 Glycyrrhetinic acid derivatives for use in treating hyperkalemia ARDELYX, INC. (US) 2024-01-02 US disclosed
US-11858959-B2 Glycyrrhetinic acid derivatives for use in treating hyperkalemia ARDELYX, INC. (US) 2024-01-02 US disclosed
US-11768319-B2 Glycyrrhetinic acid derivatives for treating hyperkalemia ARDELYX, INC. (US) 2023-09-26 US disclosed
US-20230277523-A1 METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2023-09-07 US disclosed
US-11312685-B2 Targeting nanoparticles TEXAS HEART INSTITUTE (US) 2022-04-26 US disclosed
US-20210253564-A1 Pyridazine Derivatives as SMARCA2/4 Degraders AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2021-08-19 US disclosed
US-20210188774-A1 Targeting Nanoparticles TEXAS CHILDREN'S HOSPITAL 2021-06-24 US disclosed
US-20210186953-A1 NHE3-BINDING COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2021-06-24 US disclosed
US-10940146-B2 NHE3-binding compounds and methods for inhibiting phosphate transport ARDELYX, INC. (US) 2021-03-09 US disclosed
US-20200368223-A1 METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2020-11-26 US disclosed
US-20190275028-A1 NHE3-BINDING COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2019-09-12 US disclosed
US-10376481-B2 Compounds and methods for inhibiting NHE-mediated antiport in the treatment of disorders associated with fluid retention or salt overload and gastrointestinal tract disorders ARDELYX, INC. (US) 2019-08-13 US disclosed
US-9932331-B2 Phenyl tetrahydroisoquinoline compound substituted with heteroaryl TAISHO PHARMACEUTICAL CO., LTD. (JP) 2018-04-03 US disclosed
US-9932331-B2 Phenyl tetrahydroisoquinoline compound substituted with heteroaryl TAISHO PHARMACEUTICAL CO., LTD. (JP) 2018-04-03 US disclosed
US-20170210736-A1 PHENYL TETRAHYDROISOQUINOLINE COMPOUND SUBSTITUTED WITH HETEROARYL TAISHO PHARMACEUTICAL CO., LTD (JP) 2017-07-27 US disclosed
US-20170210736-A1 PHENYL TETRAHYDROISOQUINOLINE COMPOUND SUBSTITUTED WITH HETEROARYL TAISHO PHARMACEUTICAL CO., LTD (JP) 2017-07-27 US disclosed
EP-2094660-A2 IMMUNOCHEMICALLY EQUIVALENT HIV DRUG ANALOGS Roche Diagnostics GmbH (DE) 2009-09-02 EP disclosed
WO-2008052737-A2 IMMUNOCHEMICALLY EQUIVALENT HIV DRUG ANALOGS ROCHE DIAGNOSTICS GMBH (DE) 2008-05-08 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 (13 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-10376481-B2 Compounds and methods for inhibiting NHE-mediated antiport in the treatment of disorders associated with fluid retention or salt overload and gastrointestinal tract disorders SLC10A1, SLC10A2, FABP2 TSHR 688/4885LMNA 3770/4885MAPT 4333/4885
US-20210188774-A1 Targeting Nanoparticles PHOSPHO1, CD47, ITGB3 TSHR 1663/4885LMNA 833/4885MAPT 3113/4885
US-20200368223-A1 METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC34A3, SLC34A2, SLC34A1 TSHR 3700/4885LMNA 3836/4885MAPT 2288/4885
US-20190275028-A1 NHE3-BINDING COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC34A3, SLC34A2, SLC34A1 TSHR 3112/4885LMNA 4327/4885MAPT 4323/4885
US-20240209019-A1 COMPOUNDS AND METHODS FOR TREATING HYPERKALEMIA REN, NHERF1, KCNJ11 TSHR 667/4885LMNA 1098/4885MAPT 3747/4885
US-11768319-B2 Glycyrrhetinic acid derivatives for treating hyperkalemia HSD11B2, HSD11B1, HSD3B2 TSHR 1541/4885LMNA 2542/4885MAPT 3787/4885
US-20170210736-A1 PHENYL TETRAHYDROISOQUINOLINE COMPOUND SUBSTITUTED WITH HETEROARYL NHERF1, SLC9A3, SLC26A3 TSHR 850/4885LMNA 3991/4885MAPT 4209/4885
US-20230277523-A1 METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC34A3, SLC34A2, SLC34A1 TSHR 3700/4885LMNA 3836/4885MAPT 2288/4885
US-11312685-B2 Targeting nanoparticles PHOSPHO1, CD47, ITGB3 TSHR 1663/4885LMNA 833/4885MAPT 3113/4885
US-10940146-B2 NHE3-binding compounds and methods for inhibiting phosphate transport SLC34A3, SLC34A2, SLC34A1 TSHR 3112/4885LMNA 4327/4885MAPT 4323/4885
US-20210253564-A1 Pyridazine Derivatives as SMARCA2/4 Degraders SMARCC1, SMARCC2, SMARCA2 TSHR 2822/4885LMNA 419/4885MAPT 3994/4885
US-11858959-B2 Glycyrrhetinic acid derivatives for use in treating hyperkalemia HSD11B2, HSD11B1, NR3C2 TSHR 772/4885LMNA 3455/4885MAPT 3972/4885
US-20210186953-A1 NHE3-BINDING COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC34A3, SLC34A2, SLC34A1 TSHR 3112/4885LMNA 4327/4885MAPT 4323/4885

“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.