SCHEMBL31330602

SCHEMBL31330602

Cn1c(C2CCC2)nc2c(Br)nc(Cl)cc2c1=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 4/20 0.37
▸ ADORA2B P29275 4/20 0.37
▸ TLR7 Q9NYK1 1/20 0.35
▸ PARG Q86W56 1/20 0.35
▸ DRD1 P21728 6/20 0.34
▸ DRD5 P21918 6/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ XBP1 P17861 1/20 0.32
▸ CRHBP P24387 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CRHR2 Q13324 1/20 0.32
▸ PDE4A P27815 2/20 0.31
▸ PDE4B Q07343 2/20 0.31
▸ PDE4C Q08493 2/20 0.31
▸ PDE4D Q08499 2/20 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
SCHEMBL31330708 0.97 ADORA2A (0.40) ADORA2AADORA2BTLR7PARGDRD1
SCHEMBL31330633 0.95 PARG (0.38) ADORA2AADORA2BTLR7PARGDRD1
SCHEMBL25359271 0.78 ADORA2A (0.38) ADORA2AADORA2BTLR7PARGDRD1
SCHEMBL31278641 0.76 EGFR (0.40) PARGMEN1LMNAKMT2A
SCHEMBL26988300 0.76 EGFR (0.40) PARGMEN1LMNAKMT2A
SCHEMBL25359931 0.75 ADORA2A (0.41) ADORA2AADORA2BTLR7PARGDRD1
SCHEMBL25361704 0.74 ADORA2A (0.42) ADORA2AADORA2BTLR7PARGDRD1
SCHEMBL31330681 0.74 — —
SCHEMBL31330465 0.74 GAA (0.46) MEN1CRHBPKMT2ACRHR2
SCHEMBL31330832 0.73 KDM4E (0.32) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4720061-A1 TREM2 AGONISTS F. Hoffmann-La Roche AG (CH) 2026-04-08 — — EP disclosed
WO-2024246018-A1 TREM2 AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2024-12-05 — — WO disclosed
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