SCHEMBL30486658

SCHEMBL30486658

CC1(C)OB(c2cc3c(cc2F)OCCO3)OC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 1/20 0.35
▸ LIPG Q9Y5X9 1/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ P2RX7 Q99572 1/20 0.33
▸ JAK2 O60674 1/20 0.30
▸ BTK Q06187 1/20 0.30
▸ PTGS2 P35354 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
SCHEMBL15335320 1.00 LPL (0.35) LPLLIPGMAPK1P2RX7JAK2
SCHEMBL16043929 0.90 LPL (0.35) LPLLIPGMAPK1P2RX7JAK2
SCHEMBL2027004 0.88 LPL (0.34) LPLLIPGMAPK1P2RX7JAK2
SCHEMBL15056617 0.84 MAPK1 (0.34) LPLLIPGMAPK1P2RX7
SCHEMBL10159440 0.82 P2RX7 (0.34) LPLLIPGMAPK1P2RX7
SCHEMBL1646761 0.81 LPL (0.44) LPLLIPGMAPK1P2RX7JAK2
SCHEMBL30955785 0.81 ALDH1A1 (0.39) LPLLIPGJAK2BTK
SCHEMBL13035936 0.81 ALDH1A1 (0.41) —
SCHEMBL16042213 0.79 LPL (0.35) LPLLIPGJAK2BTK
SCHEMBL20408805 0.79 MAPK1 (0.34) MAPK1P2RX7JAK2BTK

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-4448526-A1 PYRAZOLOPYRAZINE COMPOUNDS AS SHP2 INHIBITORS GENZYME CORPORATION (US) 2024-10-23 — — EP disclosed
WO-2023114954-A1 PYRAZOLOPYRAZINE COMPOUNDS AS SHP2 INHIBITORS GENZYME CORPORATION (US) 2023-06-22 — — WO disclosed
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