SCHEMBL25232467

SCHEMBL25232467

COC(=O)Cc1cncc(B2OC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
DGAT1 O75907 1/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
HSP90AB1 P08238 1/20 0.40
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
F11 P03951 1/20 0.36
PDGFRB P09619 1/20 0.35
KDR P35968 1/20 0.35
LIPG Q9Y5X9 3/20 0.35
HIF1A Q16665 2/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
GAA P10253 1/20 0.35
GFER P55789 1/20 0.35
LPL P06858 2/20 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
SCHEMBL23881427 0.87 GSK3A (0.39) DGAT1GSK3AGSK3BNPC1F11
SCHEMBL3802936 0.85 CYP11B1 (0.46) CYP11B1CYP11B2DGAT1GSK3AGSK3B
SCHEMBL3616244 0.85 LIPG (0.42) CYP11B1CYP11B2DGAT1GSK3AGSK3B
SCHEMBL3514621 0.84 GSK3A (0.43) CYP11B2DGAT1GSK3AGSK3BF11
SCHEMBL16052161 0.83 F11 (0.43) CYP11B2DGAT1GSK3AGSK3BF11
SCHEMBL3792816 0.82 LIPG (0.48) CYP11B1CYP11B2DGAT1ALDH1A1KDM4E
SCHEMBL16196202 0.82 ALDH1A1 (0.49) DGAT1ALDH1A1MAPK1PDGFRBKDR
SCHEMBL3451376 0.80 DGAT1 (0.40) DGAT1GSK3AGSK3BF11PDGFRB
SCHEMBL137029 0.80 LIPG (0.53) DGAT1GSK3AGSK3BHSP90AB1ALDH1A1
SCHEMBL17847042 0.79 F11 (0.40) CYP11B1CYP11B2DGAT1GSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250059185-A1 BICYCLIC HETEROCYCLIC COMPOUNDS USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2025-02-20 US disclosed
EP-4448522-A1 BICYCLIC HETEROCYCLIC COMPOUNDS USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2024-10-23 EP disclosed
WO-2023110958-A1 BICYCLIC HETEROCYCLIC COMPOUNDS USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2023-06-22 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 (1 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-20250059185-A1 BICYCLIC HETEROCYCLIC COMPOUNDS USEFUL AS MONOACYLGLYCEROL LIPASE INHIBITORS MGLL, LIPC, PNLIP CYP11B1 1841/4885CYP11B2 1702/4885DGAT1 62/4885

“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.