SCHEMBL6183770

SCHEMBL6183770

CCNC(N)=NOCCOCCOCC

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.31

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
SCHEMBL6187224 0.98 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL17395740 0.81 NOS1 (0.40) ALDH1A1TSHR
SCHEMBL17402478 0.81 NOS1 (0.40) ALDH1A1TSHR
SCHEMBL6182931 0.81 DDAH1 (0.35)
SCHEMBL1789536 0.80
SCHEMBL18474258 0.74 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL5839297 0.64 ALDH1A1 (0.56) ALDH1A1TSHR
SCHEMBL989839 0.64 ALDH1A1 (0.56) ALDH1A1TSHR
SCHEMBL987828 0.64 ALDH1A1 (0.56) ALDH1A1TSHR
SCHEMBL9639226 0.64 ALDH1A1 (0.56) ALDH1A1TSHR

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
EP-1532963-A1 Composition for straightening the hair comprising at least one imine not being an hydroxide L'OREAL (FR) 2005-05-25 EP disclosed
EP-1532960-A1 Hair styling composition containing a non-hydroxide imine L'OREAL (FR) 2005-05-25 EP disclosed