SCHEMBL28065026

SCHEMBL28065026

CC(C)(C)C(=O)ON1CCC(CC#N)CC1c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 10/20 0.44
▸ CFB P00751 1/20 0.43
▸ KDM1A O60341 1/20 0.35
▸ SLC6A2 P23975 2/20 0.33
▸ SLC6A4 P31645 2/20 0.33
▸ SLC6A3 Q01959 2/20 0.33
▸ HRH3 Q9Y5N1 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
SCHEMBL28065027 0.79 RIPK1 (0.50) RIPK1CFBKDM1AHRH3
SCHEMBL16409384 0.78 RIPK1 (0.44) RIPK1CFB
SCHEMBL16400851 0.76 CFB (0.46) RIPK1CFBKDM1A
SCHEMBL28858375 0.72 CFB (0.58) RIPK1CFBKDM1A
SCHEMBL28065036 0.72 RIPK1 (0.43) RIPK1KDM1A
SCHEMBL27807760 0.72 MEN1 (0.35) —
SCHEMBL20011760 0.72 CFB (0.43) RIPK1CFBKDM1A
SCHEMBL28065018 0.71 RIPK1 (0.41) RIPK1HRH3
SCHEMBL28063655 0.70 RIPK1 (0.48) RIPK1SLC6A2SLC6A4SLC6A3
SCHEMBL28064896 0.70 RIPK1 (0.48) RIPK1HRH3

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
CN-105579444-A Piperidinylindole derivatives and their use as complement factor B inhibitors NOVARTIS AG 2016-05-11 — — CN disclosed
Send feedback