SCHEMBL22632425

SCHEMBL22632425

Cc1cc2cc(B3OC(C)(C)C(C)(C)O3)ccc2n(COCC[Si](C)(C)C)c1=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.41
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.35
LPL P06858 8/20 0.33
LIPG Q9Y5X9 8/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
PRMT5 O14744 2/20 0.32
WDR77 Q9BQA1 2/20 0.32
CSF1R P07333 1/20 0.32
HIF1A Q16665 1/20 0.31
PARG Q86W56 1/20 0.31
SNCA P37840 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
SCHEMBL29414706 1.00 NPC1 (0.41) NPC1IDO1TDO2IRAK4LPL
SCHEMBL27153282 0.82 NPC1 (0.39) NPC1IDO1TDO2IRAK4LPL
SCHEMBL25346913 0.81 IRAK4 (0.36) NPC1IDO1TDO2IRAK4LPL
SCHEMBL29513926 0.81 IRAK4 (0.36) NPC1IDO1TDO2IRAK4LPL
SCHEMBL18189926 0.79 NPC1 (0.37) NPC1IRAK4LPLLIPGCA1
SCHEMBL22632582 0.78 NPC1 (0.46) NPC1
SCHEMBL26919614 0.78 IRAK4 (0.38) NPC1IDO1TDO2IRAK4LPL
SCHEMBL29835702 0.78 IRAK4 (0.38) NPC1IDO1TDO2IRAK4LPL
SCHEMBL20604761 0.78 LPL (0.35) NPC1IRAK4LPLLIPGCA1
SCHEMBL31387262 0.77 IRAK4 (0.41) IRAK4LPLLIPGCA1CA2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304561-A1 MODULATORS OF THR-BETA AND METHODS OF USE THEREOF ALIGOS THERAPEUTICS, INC. (US) 2025-10-02 US disclosed
EP-4523692-A2 MODULATORS OF THR-SS AND METHODS OF USE THEREOF Aligos Therapeutics, Inc. (US) 2025-03-19 EP disclosed
EP-3965884-B1 MODULATORS OF THR-BETA WITH A DIOXO-1,2,4-TRIAZYL HEAD GROUP ALIGOS THERAPEUTICS INC (US) 2025-01-15 EP disclosed
US-12180192-B2 Modulators of THR-β and methods of use thereof ALIGOS THERAPEUTICS, INC. (US) 2024-12-31 US disclosed
EP-3965884-A1 MODULATORS OF THR-BETA AND METHODS OF USE THEREOF Aligos Therapeutics, Inc. (US) 2022-03-16 EP disclosed
CN-114096531-A THR-beta modulators and methods of use thereof 阿利戈斯治疗公司 2022-02-25 CN disclosed
US-20210355112-A1 MODULATORS OF THR-BETA AND METHODS OF USE THEREOF ALIGOS THERAPEUTICS, INC. (US) 2021-11-18 US disclosed
US-11091467-B2 Modulators of THR-β and methods of use thereof ALIGOS THERAPEUTICS, INC. (US) 2021-08-17 US disclosed
US-20200354345-A1 MODULATORS OF THR-BETA AND METHODS OF USE THEREOF ALIGOS THERAPEUTICS, INC. (US) 2020-11-12 US disclosed
WO-2020227549-A1 MODULATORS OF THR-β AND METHODS OF USE THEREOF ALIGOS THERAPEUTICS, INC. (US) 2020-11-12 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 (5 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-20210355112-A1 MODULATORS OF THR-BETA AND METHODS OF USE THEREOF THRB, THRA, TRHR NPC1 2683/4885IDO1 1971/4885TDO2 1199/4885
US-20250304561-A1 MODULATORS OF THR-BETA AND METHODS OF USE THEREOF THRB, THRA, TRHR NPC1 3125/4885IDO1 1533/4885TDO2 1070/4885
US-20200354345-A1 MODULATORS OF THR-BETA AND METHODS OF USE THEREOF THRB, THRA, TRHR NPC1 2683/4885IDO1 1971/4885TDO2 1199/4885
US-12180192-B2 Modulators of THR-β and methods of use thereof THRB, THRA, TRHR NPC1 2374/4885IDO1 2168/4885TDO2 1308/4885
US-11091467-B2 Modulators of THR-β and methods of use thereof THRB, THRA, TRHR NPC1 2374/4885IDO1 2168/4885TDO2 1308/4885

“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.