SCHEMBL16401485

SCHEMBL16401485

NS(=O)(=O)c1ccc(C2CCCCN2C(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 12/20 0.54
CA1 P00915 11/20 0.54
CA12 O43570 8/20 0.54
CA9 Q16790 8/20 0.54
CA7 P43166 7/20 0.54
CA14 Q9ULX7 7/20 0.54
CPT1A P50416 1/20 0.44
USP2 O75604 1/20 0.43
CFB P00751 1/20 0.43
RIPK1 Q13546 1/20 0.43
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
APH1B Q8WW43 1/20 0.42
NCSTN Q92542 1/20 0.42
APH1A Q96BI3 1/20 0.42
PSENEN Q9NZ42 1/20 0.42
HSD11B1 P28845 1/20 0.41

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
SCHEMBL16401122 0.86 RIPK1 (0.46) CA2CA1CA12CA9CA7
SCHEMBL16401682 0.84 ROCK2 (0.49) CA2CA1CA12CA9CA7
SCHEMBL12478830 0.82 PPID (0.48) RIPK1HSD11B1
SCHEMBL16409297 0.82 CA2 (0.51) CA2CA1CA12CA9CA7
SCHEMBL216202 0.80 RIPK1 (0.62) RIPK1HSD11B1
SCHEMBL27574946 0.80 RIPK1 (0.62) RIPK1HSD11B1
SCHEMBL27574934 0.80 RIPK1 (0.62) RIPK1HSD11B1
SCHEMBL21962365 0.80 RIPK1 (0.49) CA2CA1CA12CA9CA7
SCHEMBL26693398 0.79 PARP14 (0.57) CPT1ACFBRIPK1HSD11B1
SCHEMBL29892279 0.79 CCNC (0.51) RIPK1HSD11B1

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-3022192-A1 PIPERIDINYL INDOLE DERIVATIVES AND THEIR USE AS COMPLEMENT FACTOR B INHIBITORS Novartis AG (CH) 2016-05-25 EP disclosed
WO-2015009616-A1 PIPERIDINYL INDOLE DERIVATIVES AND THEIR USE AS COMPLEMENT FACTOR B INHIBITORS NOVARTIS AG (CH) 2015-01-22 WO disclosed