SCHEMBL17530750

SCHEMBL17530750

Cc1ccc(S(=O)(=O)N2CCOC23CCN(S(=O)(=O)c2cc(F)ccc2F)CC3)cc1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.58
▸ RAB9A P51151 1/20 0.58
▸ PKM P14618 1/20 0.55
▸ L3MBTL1 Q9Y468 2/20 0.55
▸ ALDH1A1 P00352 1/20 0.46

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
SCHEMBL12621845 0.84 L3MBTL1 (0.65) PKML3MBTL1ALDH1A1
SCHEMBL12622049 0.82 L3MBTL1 (0.58) PKML3MBTL1ALDH1A1
SCHEMBL13035869 0.80 L3MBTL1 (0.60) PKML3MBTL1ALDH1A1
SCHEMBL12622173 0.79 L3MBTL1 (0.53) L3MBTL1ALDH1A1
SCHEMBL12621982 0.78 ALDH1A1 (0.60) L3MBTL1ALDH1A1
SCHEMBL12626029 0.78 ALDH1A1 (0.60) L3MBTL1ALDH1A1
SCHEMBL22191895 0.77 L3MBTL1 (0.75) PKML3MBTL1ALDH1A1
SCHEMBL12624020 0.77 L3MBTL1 (0.58) L3MBTL1ALDH1A1
SCHEMBL20787973 0.76 L3MBTL1 (0.54) L3MBTL1ALDH1A1
SCHEMBL12621946 0.76 L3MBTL1 (0.61) L3MBTL1ALDH1A1

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-2498600-B1 FILAMIN A-BINDING ANTI-INFLAMMATORY ANALGESIC PAIN THERAPEUTICS INC (US) 2016-03-02 — — EP disclosed
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