SCHEMBL31308775

SCHEMBL31308775

FC(F)(F)Oc1cccc([Mg]Br)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 3/20 0.41
▸ PIM1 P11309 1/20 0.39
▸ PIM2 Q9P1W9 1/20 0.39
▸ GPR3 P46089 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ KIF11 P52732 2/20 0.38
▸ CHRM2 P08172 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ CHRM3 P20309 1/20 0.37
▸ SLC22A12 Q96S37 1/20 0.36
▸ DAO P14920 1/20 0.36
▸ MPI P34949 1/20 0.36
▸ XDH P47989 1/20 0.36
▸ GALR1 P47211 1/20 0.36

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
SCHEMBL624234 1.00 CETP (0.41) CETPPIM1PIM2GPR3ALDH1A1
SCHEMBL30096837 0.85 CETP (0.31) CETP
SCHEMBL27219501 0.85 CETP (0.31) CETP
SCHEMBL29058645 0.81 CETP (0.41) CETPPIM1PIM2GPR3KIF11
SCHEMBL3147185 0.79 GPR3 (0.50) CETPPIM1PIM2GPR3KIF11
SCHEMBL513339 0.75 MAPT (0.42) PIM1PIM2GPR3ALDH1A1MAPT
SCHEMBL3146332 0.75 GPR3 (0.44) CETPPIM1PIM2GPR3ALDH1A1
SCHEMBL24031 0.74 ACHE (0.50) ALDH1A1
SCHEMBL29411044 0.74 ACHE (0.50) ALDH1A1
SCHEMBL29351368 0.74 MAOB (0.46) CETPGPR3ALDH1A1GAAMAPT

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
WO-2025068347-A1 NEW HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2025-04-03 — — WO disclosed
US-20250099448-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-03-27 — — US disclosed
CN-119301113-A Novel heterocyclic carbonyl cyclic compounds as MAGL inhibitors 豪夫迈·罗氏有限公司 2025-01-10 — — CN 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-20250099448-A1 HETEROCYCLIC COMPOUNDS OPRM1, CYP1A1, CYP3A4 CETP 4155/4885PIM1 3447/4885PIM2 3880/4885

“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.

Send feedback