SCHEMBL24906231

SCHEMBL24906231

CCOC(=O)c1c(I)c(C2CC2)nn1COCC[Si](C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.39
KLKB1 P03952 3/20 0.36
ALDH1A1 P00352 3/20 0.34
TSHR P16473 3/20 0.34
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
FDFT1 P37268 1/20 0.32
FAAH O00519 1/20 0.32
HPGD P15428 2/20 0.31
P2RX7 Q99572 1/20 0.30
DHODH Q02127 1/20 0.30

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
SCHEMBL24906232 0.84 DGAT1 (0.42) DGAT1KLKB1ALDH1A1TSHRGAA
SCHEMBL22900570 0.81 DGAT1 (0.35) DGAT1ALDH1A1HTTHSD17B10HPGD
SCHEMBL24906233 0.80 DGAT1 (0.37) DGAT1KLKB1ALDH1A1FDFT1
SCHEMBL30975943 0.79 DGAT1 (0.35) DGAT1
SCHEMBL24906277 0.79 KDM4E (0.38) DGAT1ALDH1A1HPGDP2RX7
SCHEMBL2362313 0.76 TSHR (0.40) ALDH1A1TSHRGAAHTTHSD17B10
SCHEMBL19806500 0.75 ALDH1A1 (0.41) DGAT1ALDH1A1GAAFAAHHPGD
SCHEMBL26958767 0.75 DGAT1 (0.41) DGAT1KLKB1ALDH1A1TSHRGAA
SCHEMBL30958818 0.74 ALDH1A1 (0.34) ALDH1A1TSHRGAAHTTHSD17B10
SCHEMBL22900533 0.74 DGAT1 (0.35) DGAT1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4634159-A1 SULFOXIMINES AS INHIBITORS OF NAV1.8 Grünenthal GmbH (DE) 2025-10-22 EP disclosed
WO-2024126648-A1 SULFOXIMINES AS INHIBITORS OF NaV1.8 Grünenthal GmbH (DE) 2024-06-20 WO disclosed
EP-4385984-A1 PYRIDINE-N-OXIDES AS INHIBITORS OF NAV1.8 Grünenthal GmbH (DE) 2024-06-19 EP disclosed
US-11999699-B2 Substituted pyrazole amides Grünenthal GmbH (DE) 2024-06-04 US disclosed
EP-4355733-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2024-04-24 EP disclosed
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES GRUENENTHAL GMBH (DE) 2023-01-26 US disclosed
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES GRUENENTHAL GMBH (DE) 2023-01-26 US disclosed
WO-2022263498-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2022-12-22 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 (2 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-11999699-B2 Substituted pyrazole amides SCN8A, SCN1A, SCN7A DGAT1 2559/4885KLKB1 3680/4885ALDH1A1 834/4885
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES SCN8A, SCN1A, SCN7A DGAT1 2559/4885KLKB1 3680/4885ALDH1A1 834/4885

“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.