SCHEMBL5810504

SCHEMBL5810504

CCCCCCCCCCCCCCCCCCC1N(C)C=CN1CCC

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.31
THRB P10828 1/20 0.31
EPHX1 P07099 2/20 0.31
DNM1 Q05193 4/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL5810762 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5810398 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5813345 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5811874 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5283216 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5281873 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5295291 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5811568 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5295781 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5291901 0.92 PTGS1 (0.33) ALDH1A1TSHRTHRB

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