SCHEMBL17057873

SCHEMBL17057873

CC1(COc2c(N3CCN([S@+]([O-])Cc4ccc5nc(-c6ccc(F)cc6)oc5c4)CC3)cnn(-c3cc(F)cc(F)c3)c2=O)CC1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ UTRN P46939 3/20 0.32
▸ FASN P49327 1/20 0.32
▸ MGLL Q99685 1/20 0.31
▸ GPR119 Q8TDV5 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ MAPT P10636 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
SCHEMBL17058018 0.88 — —
SCHEMBL17058268 0.88 — —
SCHEMBL11946291 0.86 POLB (0.34) UTRNFASNMGLLGPR119LMNA
SCHEMBL17058559 0.83 POLB (0.33) —
SCHEMBL17057972 0.82 POLB (0.33) —
SCHEMBL11946289 0.82 GPR119 (0.32) FASNGPR119MAPT
SCHEMBL17058475 0.81 — —
SCHEMBL17058289 0.78 NPBWR1 (0.34) —
SCHEMBL17058032 0.78 — —
SCHEMBL17058558 0.77 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137179-B1 PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS MERCK SHARP & DOHME (US) 2015-09-02 — — EP disclosed
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