SCHEMBL18855841

SCHEMBL18855841

Cc1ccc(S(=O)(=O)n2ccc3nc(NNC=O)cnc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
ALDH3A1 P30838 2/20 0.38
NOD1 Q9Y239 2/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38
BRD4 O60885 1/20 0.35
RAPGEF4 Q8WZA2 2/20 0.34
KDM4E B2RXH2 2/20 0.34
PKM P14618 1/20 0.34
UBE2N P61088 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CYP2C19 P33261 1/20 0.34
ENPP3 O14638 1/20 0.33
ENPP1 P22413 1/20 0.33
MET P08581 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33

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
SCHEMBL18855510 0.90 L3MBTL1 (0.50) L3MBTL1ALDH3A1NOD1POLBHTT
SCHEMBL27893073 0.86 L3MBTL1 (0.53) L3MBTL1ALDH3A1NOD1POLBHTT
Hydrochloric Acid SCHEMBL27838799 0.84 L3MBTL1 (0.52) L3MBTL1ALDH3A1NOD1POLBHTT
SCHEMBL1934124 0.84 L3MBTL1 (0.47) L3MBTL1ALDH3A1NOD1POLBHTT
SCHEMBL26451130 0.83 L3MBTL1 (0.51) L3MBTL1ALDH3A1NOD1POLBHTT
SCHEMBL1536134 0.83 L3MBTL1 (0.51) L3MBTL1ALDH3A1NOD1POLBHTT
SCHEMBL18855429 0.83 L3MBTL1 (0.46) L3MBTL1ALDH3A1NOD1POLBHTT
SCHEMBL14795013 0.83 L3MBTL1 (0.46) L3MBTL1ALDH3A1NOD1POLBHTT
Formic Acid SCHEMBL27873518 0.83 L3MBTL1 (0.46) L3MBTL1ALDH3A1NOD1POLBHTT
SCHEMBL4348950 0.81 L3MBTL1 (0.49) L3MBTL1ALDH3A1NOD1POLBHTT

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-3950692-A1 NOVEL TRICYCLIC COMPOUNDS AbbVie Inc. (US) 2022-02-09 EP disclosed
EP-2506716-B1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC (US) 2017-05-17 EP disclosed