SCHEMBL5811413

SCHEMBL5811413

CCCCCCCC[N+](C)=C(SC)N(C)C

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
DNM1 Q05193 8/20 0.32
TSHR P16473 2/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 2/20 0.30
HTT P42858 1/20 0.30
LMNA P02545 2/20 0.30
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
SLC22A1 O15245 1/20 0.30

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
SCHEMBL5813200 1.00 ALDH1A1 (0.33) ALDH1A1DNM1TSHRTHRBKMT2A
SCHEMBL5814821 1.00 ALDH1A1 (0.33) ALDH1A1DNM1TSHRTHRBKMT2A
SCHEMBL5813204 1.00 ALDH1A1 (0.33) ALDH1A1DNM1TSHRTHRBKMT2A
SCHEMBL5814818 1.00 ALDH1A1 (0.33) ALDH1A1DNM1TSHRTHRBKMT2A
SCHEMBL5811831 1.00 ALDH1A1 (0.33) ALDH1A1DNM1TSHRTHRBKMT2A
SCHEMBL5815790 1.00 ALDH1A1 (0.33) ALDH1A1DNM1TSHRTHRBKMT2A
SCHEMBL5811412 1.00 ALDH1A1 (0.33) ALDH1A1DNM1TSHRTHRBKMT2A
SCHEMBL5815794 1.00 ALDH1A1 (0.33) ALDH1A1DNM1TSHRTHRBKMT2A
SCHEMBL5816154 1.00 ALDH1A1 (0.33) ALDH1A1DNM1TSHRTHRBKMT2A
SCHEMBL5814116 1.00 ALDH1A1 (0.33) ALDH1A1DNM1TSHRTHRBKMT2A

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
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 WO disclosed