SCHEMBL20019612

SCHEMBL20019612

CC(O)c1ccc(S(=O)(=O)N2CCC3(CC2)NCCS3)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.45
▸ MCOLN3 Q8TDD5 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ LMNA P02545 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ PKM P14618 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CYP2D6 P10635 3/20 0.37
▸ GAA P10253 1/20 0.36

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
SCHEMBL12624076 0.83 ALDH1A1 (0.60) POLBALDH1A1LMNAMEN1KMT2A
SCHEMBL17082811 0.81 ALDH1A1 (0.41) ALDH1A1L3MBTL1LMNAMEN1KMT2A
SCHEMBL12656502 0.79 L3MBTL1 (0.38) POLBALDH1A1L3MBTL1LMNAMEN1
SCHEMBL12624052 0.78 ALDH1A1 (0.48) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL12624048 0.76 POLB (0.54) POLBMCOLN3ALDH1A1L3MBTL1LMNA
SCHEMBL20739694 0.73 POLB (0.49) POLBMCOLN3ALDH1A1LMNAMEN1
SCHEMBL12622104 0.70 POLB (0.55) POLBALDH1A1L3MBTL1
SCHEMBL12626263 0.68 ALDH1A1 (0.50) POLBALDH1A1L3MBTL1LMNANPC1
SCHEMBL12656158 0.66 POLB (0.67) POLBMCOLN3ALDH1A1LMNAMEN1
SCHEMBL10723723 0.65 MCOLN3 (0.75) POLBMCOLN3ALDH1A1LMNAMEN1

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-2918587-B1 Filamin A binding compounds and their use as anti-inflammatory and analgesic agents PAIN THERAPEUTICS INC (US) 2018-04-04 — — EP disclosed
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