SCHEMBL1110085

SCHEMBL1110085

CCC(C)CC(C)CC(C)CC(C)CS

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.32
ERAP2 Q6P179 1/20 0.32
ERAP1 Q9NZ08 1/20 0.32

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
SCHEMBL1865283 0.97
SCHEMBL15629139 0.84 TSHR (0.38)
SCHEMBL19275065 0.84
SCHEMBL20446708 0.81
SCHEMBL23815 0.81
SCHEMBL8819119 0.81
SCHEMBL24736823 0.80
SCHEMBL83545 0.80
SCHEMBL25950662 0.79 ANPEP (0.54) ANPEPERAP2ERAP1
SCHEMBL18754958 0.77 ALDH1A1 (0.35)

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-2280009-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS AND FUNGICIDES FOR AGRICULTURAL AND HORTICULTURAL USE Nippon Soda Co., Ltd. (JP) 2011-02-02 EP disclosed