SCHEMBL5286352

SCHEMBL5286352

CCCCCCCCCCCCCCCCCCC1N(C)C=CN1CC

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
SCHEMBL5304433 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5291243 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5815548 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5283098 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5293510 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5304211 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5305555 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5817012 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5814163 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1
SCHEMBL5292672 1.00 ALDH1A1 (0.32) ALDH1A1TSHRTHRBEPHX1DNM1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 WO disclosed