SCHEMBL31085162

SCHEMBL31085162

Cn1c(=O)nc(O)c2nc(COCc3ccccc3)n(CC(F)F)c21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
MAPK1 P28482 3/20 0.36
USP2 O75604 1/20 0.36
PKM P14618 1/20 0.35
FBP1 P09467 1/20 0.35
VCP P55072 1/20 0.33
APLNR P35414 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
KDM4E B2RXH2 2/20 0.32
CA1 P00915 1/20 0.32
TSHR P16473 2/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 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
SCHEMBL31085183 0.87 MAOA (0.36) MAOAMAOBMAPK1USP2PKM
SCHEMBL31085083 0.84 TSHR (0.38) MAOAMAOBMAPK1USP2PKM
SCHEMBL31085270 0.81 MAPK1 (0.46) MAOAMAOBMAPK1USP2KDM4E
SCHEMBL31085053 0.81 ADORA1 (0.37) MAOAMAOBMAPK1USP2PKM
SCHEMBL31085266 0.78 TSHR (0.36) MAPK1FBP1VCPAPLNRL3MBTL1
SCHEMBL31085182 0.75 GPR119 (0.39) HDAC1
SCHEMBL22225040 0.68 TSHR (0.40) MAPK1USP2VCPL3MBTL1TSHR
SCHEMBL31085104 0.67 ALDH1A1 (0.46) MAPK1USP2KDM4ETSHRALDH1A1
SCHEMBL31085126 0.63 MEN1 (0.32) L3MBTL1
SCHEMBL20793061 0.62 MAOB (0.63) MAOAMAOBPKML3MBTL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260125378-A2 Heterocyclic Compounds BEONE MEDICINES I GMBH (CH) 2026-05-07 US disclosed
EP-4658650-A1 HETEROCYCLIC COMPOUNDS Beone Medicines I GmbH (CH) 2025-12-10 EP disclosed
US-20250353846-A1 Heterocyclic Compounds BEONE MEDICINES I GMBH (CH) 2025-11-20 US disclosed
WO-2024160277-A1 HETEROCYCLIC COMPOUNDS BEIGENE, LTD. (KY) 2024-08-08 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-20260125378-A2 Heterocyclic Compounds NFATC1, CD4, MALT1 MAOA 2893/4885MAOB 2174/4885MAPK1 1308/4885
US-20250353846-A1 Heterocyclic Compounds NFATC1, CD4, ACIN1 MAOA 2511/4885MAOB 3044/4885MAPK1 983/4885

“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.