SCHEMBL20117218

SCHEMBL20117218

CC(C)(N)CCCC1CCCCC1(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL20117212 0.95 ALDH1A1 (0.32) ALDH1A1TDP1
SCHEMBL25581284 0.92 SIGMAR1 (0.33) ALDH1A1TDP1
SCHEMBL25893778 0.90 TDP1 (0.32) ALDH1A1TDP1
SCHEMBL18513184 0.83
SCHEMBL20117308 0.82
SCHEMBL18513286 0.81
SCHEMBL18513207 0.81
SCHEMBL20171237 0.78
SCHEMBL25996312 0.77
SCHEMBL25816767 0.76 SIGMAR1 (0.31)

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-3015494-B1 FLAME-RETARDANT SHEET OR FILM, PRODUCTS COMPRISING THE SAME AND PROCESS FOR PRODUCTION THEREOF MITSUBISHI GAS CHEMICAL CO (JP) 2018-05-02 EP disclosed