SCHEMBL18463229

SCHEMBL18463229

C=C(C)CCCCC(N)CCN

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.40
▸ ENPEP Q07075 1/20 0.34
▸ TRPV1 Q8NER1 1/20 0.32
▸ TRPA1 O75762 1/20 0.32
▸ S1PR2 O95136 5/20 0.32
▸ S1PR1 P21453 5/20 0.32
▸ S1PR3 Q99500 5/20 0.32
▸ S1PR4 O95977 4/20 0.32
▸ PAOX Q6QHF9 1/20 0.31
▸ GABBR2 O75899 1/20 0.30
▸ GABBR1 Q9UBS5 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
SCHEMBL20064328 0.81 ALDH1A1 (0.41) ALDH1A1ENPEPS1PR2S1PR1S1PR3
SCHEMBL18648402 0.79 PAOX (0.56) ALDH1A1ENPEPS1PR2S1PR1S1PR3
SCHEMBL24799699 0.79 ALDH1A1 (0.40) ALDH1A1ENPEPTRPV1TRPA1S1PR2
SCHEMBL24800558 0.79 ALDH1A1 (0.44) ALDH1A1ENPEPTRPV1TRPA1S1PR2
SCHEMBL24267043 0.77 ALDH1A1 (0.50) ALDH1A1ENPEPS1PR2S1PR1S1PR3
SCHEMBL3487034 0.76 ENPEP (0.36) ALDH1A1ENPEPTRPV1TRPA1S1PR2
SCHEMBL20367002 0.75 LMNA (0.36) TRPV1TRPA1PAOXGABBR2GABBR1
SCHEMBL467091 0.74 — —
SCHEMBL30431198 0.74 TRPV1 (0.39) ALDH1A1TRPV1TRPA1S1PR2S1PR1
SCHEMBL20118208 0.73 PAOX (0.43) ALDH1A1TRPV1TRPA1PAOX

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-2017019789-A1 CO-DOPED CORE/SHELL NANOCRYSTALS FOR VISIBLE LIGHT EMISSION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-02-02 — — WO disclosed
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