SCHEMBL17866121

SCHEMBL17866121

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

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 10/20 0.43
▸ MAPT P10636 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ ATM Q13315 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CTSS P25774 6/20 0.38
▸ ITGB3 P05106 1/20 0.38
▸ ITGA2B P08514 1/20 0.38
▸ CTSL P07711 1/20 0.37
▸ CTSB P07858 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SYK P43405 1/20 0.35

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
SCHEMBL7275539 1.00 CTSK (0.43) CTSKMAPTCA1CA2CA7
SCHEMBL7116478 1.00 CTSK (0.43) CTSKMAPTCA1CA2CA7
SCHEMBL7743860 0.89 CTSK (0.49) CTSKMAPTCA1CA2CA7
SCHEMBL7275058 0.86 CTSK (0.42) CTSKMAPTCA1CA2CA7
SCHEMBL17903255 0.86 CTSK (0.42) CTSKMAPTCA1CA2CA7
SCHEMBL6684772 0.85 CA1 (0.49) CTSKCA1CA2CA7ATM
SCHEMBL211054 0.84 CTSK (0.45) CTSKMAPTCA1CA2CA7
SCHEMBL5196572 0.84 CTSK (0.45) CTSKMAPTCA1CA2CA7
SCHEMBL211053 0.84 CTSK (0.45) CTSKMAPTCA1CA2CA7
SCHEMBL12290180 0.84 CTSK (0.45) CTSKMAPTCA1CA2CA7

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-20220081423-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2022-03-17 — — US disclosed
US-11028075-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2021-06-08 — — US disclosed
US-11028075-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2021-06-08 — — US disclosed
CN-112041313-A Pyridine-sulfonamide compounds and their use against pain and related conditions 基因泰克公司 2020-12-04 — — CN disclosed
US-20200115354-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2020-04-16 — — US disclosed
US-20200115354-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2020-04-16 — — US disclosed
US-10457654-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2019-10-29 — — US disclosed
US-10457654-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2019-10-29 — — US disclosed
WO-2019165290-A1 PYRIDINE-SULFONAMIDE COMPOUNDS AND THEIR USE AGAINST PAIN AND RELATED CONDITIONS GENENTECH, INC. (US) 2019-08-29 — — WO disclosed
US-20190263786-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2019-08-29 — — US disclosed
WO-2018072602-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-26 — — WO disclosed
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-19 — — US disclosed
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-19 — — US disclosed
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-19 — — US disclosed
EP-3037424-B1 NOVEL QUINOLINE-SUBSTITUTED COMPOUND TAIHO PHARMACEUTICAL CO LTD (JP) 2017-11-08 — — EP disclosed
US-9758526-B2 Quinoline-substituted compound TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-09-12 — — US disclosed
US-9650386-B2 Quinoline-substituted compound Taiho Pharmaceutical Co., Inc. (JP) 2017-05-16 — — US disclosed
US-20170101414-A1 NOVEL QUINOLINE-SUBSTITUTED COMPOUND TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-04-13 — — US disclosed
US-20160194332-A1 NOVEL QUINOLINE -SUBSTITUTED COMPOUND TAIHO PHARMACEUTICAL CO., LTD. (JP) 2016-07-07 — — US disclosed
EP-3037424-A1 NOVEL QUINOLINE-SUBSTITUTED COMPOUND Taiho Pharmaceutical Co., Ltd. (JP) 2016-06-29 — — 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 (8 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-20190263786-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF ASAH2, ACER2, PCSK9 CTSK 579/4885MAPT 1547/4885CA1 326/4885
US-20220081423-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF TRPV1, HCN4, TRPA1 CTSK 2607/4885MAPT 3785/4885CA1 589/4885
US-20200115354-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF NPY5R, REN, F12 CTSK 2360/4885MAPT 3593/4885CA1 1419/4885
US-10457654-B2 Therapeutic compounds and methods of use thereof NPY5R, REN, F12 CTSK 2360/4885MAPT 3593/4885CA1 1419/4885
US-20170101414-A1 NOVEL QUINOLINE-SUBSTITUTED COMPOUND EGFR, ERBB2, ERBB4 CTSK 1735/4885MAPT 4330/4885CA1 4015/4885
US-20160194332-A1 NOVEL QUINOLINE -SUBSTITUTED COMPOUND EGFR, ERBB2, ERBB4 CTSK 1735/4885MAPT 4330/4885CA1 4015/4885
US-11028075-B2 Therapeutic compounds and methods of use thereof TRPV1, HCN4, TRPA1 CTSK 2607/4885MAPT 3785/4885CA1 589/4885
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF NPY5R, REN, F12 CTSK 2350/4885MAPT 3628/4885CA1 1455/4885

“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.

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