SCHEMBL22792428

SCHEMBL22792428

CC1(C)OB(c2ncc(F)cc2F)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 2/20 0.40
▸ LIPG Q9Y5X9 2/20 0.40
▸ EGFR P00533 1/20 0.31
▸ IDO1 P14902 1/20 0.30
▸ TDO2 P48775 1/20 0.30
▸ P2RX7 Q99572 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
SCHEMBL30568470 1.00 LPL (0.40) LPLLIPGEGFRIDO1TDO2
SCHEMBL20203112 0.83 LPL (0.34) LPLLIPGEGFR
SCHEMBL15393439 0.76 LPL (0.41) LPLLIPGEGFRIDO1TDO2
SCHEMBL17752336 0.74 LPL (0.39) LPLLIPGEGFRIDO1TDO2
SCHEMBL31378591 0.74 LPL (0.39) LPLLIPGEGFRIDO1TDO2
SCHEMBL22947113 0.73 GSK3A (0.35) LPLLIPG
SCHEMBL21911080 0.72 LPL (0.38) LPLLIPGIDO1TDO2
SCHEMBL30508645 0.72 LPL (0.38) LPLLIPGEGFRIDO1TDO2
SCHEMBL15392968 0.72 LPL (0.38) LPLLIPGEGFRIDO1TDO2
SCHEMBL9977811 0.72 LPL (0.33) LPLLIPGIDO1TDO2

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-2023148129-A1 IMIDAZOLE MACROCYCLES FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2023-08-10 — — WO disclosed
EP-3985005-A1 FUSED RING COMPOUND AS FGFR AND VEGFR DUAL INHIBITOR Medshine Discovery Inc. (CN) 2022-04-20 — — EP disclosed
WO-2020249096-A1 FUSED RING COMPOUND AS FGFR AND VEGFR DUAL INHIBITOR 南京明德新药研发有限公司 2020-12-17 — — WO disclosed
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