SCHEMBL1889631

SCHEMBL1889631

COC(=O)[C@@H](NCc1ccccc1)C(C)C

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.59
MAPT P10636 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
ANPEP P15144 1/20 0.51
ALDH1A1 P00352 3/20 0.50
GAA P10253 1/20 0.50
HCRTR2 O43614 1/20 0.50
MEP1B Q16820 2/20 0.49
ATM Q13315 1/20 0.49
CA12 O43570 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
ITGB3 P05106 1/20 0.48
ITGB1 P05556 1/20 0.48
ITGAV P06756 1/20 0.48
ITGA5 P08648 1/20 0.48
SIGMAR1 Q99720 1/20 0.47

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
SCHEMBL24326690 1.00 TRPM8 (0.59) TRPM8MAPTL3MBTL1MEN1KMT2A
SCHEMBL1889629 1.00 TRPM8 (0.59) TRPM8MAPTL3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL5808835 0.97 TRPM8 (0.56) TRPM8MAPTL3MBTL1MEN1KMT2A
SCHEMBL30220325 0.89 TRPM8 (0.58) TRPM8MAPTL3MBTL1MEN1KMT2A
SCHEMBL19520951 0.89 TRPM8 (0.58) TRPM8MAPTL3MBTL1MEN1KMT2A
SCHEMBL16851474 0.89 TRPM8 (0.58) TRPM8MAPTL3MBTL1MEN1KMT2A
SCHEMBL19520949 0.89 TRPM8 (0.58) TRPM8MAPTL3MBTL1MEN1KMT2A
SCHEMBL7424210 0.89 TRPM8 (0.58) TRPM8MAPTL3MBTL1MEN1KMT2A
SCHEMBL7424214 0.89 TRPM8 (0.58) TRPM8MAPTL3MBTL1MEN1KMT2A
SCHEMBL4166663 0.86 TRPM8 (0.55) TRPM8MAPTL3MBTL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260085060-A1 THERAPEUTIC COMPOUNDS INDIVIOR UK LTD (GB) 2026-03-26 US disclosed
US-12441709-B2 Therapeutic compounds INDIVIOR UK LIMITED (GB) 2025-10-14 US disclosed
US-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor C4X DISCOVERY LIMITED (GB) 2024-07-02 US disclosed
US-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor C4X DISCOVERY LIMITED (GB) 2024-07-02 US disclosed
US-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor C4X DISCOVERY LIMITED (GB) 2024-07-02 US disclosed
US-20240076282-A1 THERAPEUTIC COMPOUNDS INDIVIOR UK LIMITED (GB) 2024-03-07 US disclosed
US-20240018161-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2024-01-18 US disclosed
US-20240018161-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2024-01-18 US disclosed
US-11753398-B2 Therapeutic compounds C4X DISCOVERY LIMITED (GB) 2023-09-12 US disclosed
CN-116670143-A Modulators of cystic fibrosis transmembrane conductance regulator 弗特克斯药品有限公司 2023-08-29 CN disclosed
US-10611760-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor C4X DISCOVERY LIMITED (GB) 2020-04-07 US disclosed
US-20170291897-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR INDIVIOR INC. 2017-10-12 US disclosed
US-20170291897-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR INDIVIOR INC. 2017-10-12 US disclosed
US-20170291897-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR INDIVIOR INC. 2017-10-12 US disclosed
EP-3189043-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR C4x Discovery Limited (GB) 2017-07-12 EP disclosed
WO-2016034882-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR C4X DISCOVERY LIMITED (GB) 2016-03-10 WO disclosed
WO-2016034882-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR C4X DISCOVERY LIMITED (GB) 2016-03-10 WO disclosed
US-20110105567-A1 Pyrrole Compounds Having Sphingosine-1-Phosphate Receptor Agonist Or Antagonist Biological Activity ALLERGAN, INC. (US) 2011-05-05 US disclosed
EP-2185506-A1 PYRROLE COMPOUNDS HAVING SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST OR ANTAGONIST BIOLOGICAL ACTIVITY Allergan, Inc. (US) 2010-05-19 EP disclosed
WO-2009026407-A1 PYRROLE COMPOUNDS HAVING SPHINGOSINE-1-PHOSPHATE RECEPTOR AGONIST OR ANTAGONIST BIOLOGICAL ACTIVITY ALLERGAN, INC. (US) 2009-02-26 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 (9 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-11753398-B2 Therapeutic compounds HCRTR2, HCRTR1, NPY1R TRPM8 276/4885MAPT 499/4885L3MBTL1 4727/4885
US-20240018161-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B TRPM8 61/4885MAPT 4857/4885L3MBTL1 3940/4885
US-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor HCRTR1, HCRTR2, NPY1R TRPM8 411/4885MAPT 557/4885L3MBTL1 4730/4885
US-20240076282-A1 THERAPEUTIC COMPOUNDS HCRTR2, HCRTR1, NPY1R TRPM8 276/4885MAPT 499/4885L3MBTL1 4727/4885
US-20110105567-A1 Pyrrole Compounds Having Sphingosine-1-Phosphate Receptor Agonist Or Antagonist Biological Activity S1PR1, S1PR2, S1PR3 TRPM8 133/4885MAPT 3241/4885L3MBTL1 4571/4885
US-12441709-B2 Therapeutic compounds HCRTR2, HCRTR1, NPY1R TRPM8 276/4885MAPT 499/4885L3MBTL1 4727/4885
US-10611760-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor HCRTR1, HCRTR2, NPY1R TRPM8 411/4885MAPT 557/4885L3MBTL1 4730/4885
US-20170291897-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR HCRTR1, HCRTR2, NPY1R TRPM8 411/4885MAPT 557/4885L3MBTL1 4730/4885
US-20260085060-A1 THERAPEUTIC COMPOUNDS HCRTR2, HCRTR1, NPY1R TRPM8 553/4885MAPT 680/4885L3MBTL1 3458/4885

“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.