Sugi Predict

Sugi Predict / Compounds / Dectaflur

Dectaflur

Dectaflur

SCHEMBL28435673

CCCCCCCCC=CCCCCCCCCN.CCCCCCCCCC(N)CCCCCCCC

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 1/20 0.51
▸ DNM1 Q05193 7/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ EPHX1 P07099 1/20 0.50
▸ S1PR2 O95136 5/20 0.49
▸ S1PR1 P21453 5/20 0.49
▸ S1PR3 Q99500 5/20 0.49
▸ S1PR4 O95977 4/20 0.49

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
SCHEMBL28357369 1.00 SLC6A5 (0.51) SLC6A5DNM1MEN1KMT2AALDH1A1
SCHEMBL443551 1.00 SLC6A5 (0.51) SLC6A5DNM1MEN1KMT2AALDH1A1
SCHEMBL448391 0.96 S1PR2 (0.49) SLC6A5DNM1MEN1KMT2AALDH1A1
SCHEMBL4788832 0.96 S1PR2 (0.49) SLC6A5DNM1MEN1KMT2AALDH1A1
SCHEMBL29002383 0.95 KDM4E (0.49) SLC6A5DNM1MEN1KMT2AALDH1A1
SCHEMBL165367 0.92 S1PR2 (0.49) SLC6A5MEN1KMT2AS1PR2S1PR1
SCHEMBL4176129 0.92 S1PR2 (0.49) SLC6A5MEN1KMT2AS1PR2S1PR1
SCHEMBL165369 0.92 S1PR2 (0.49) SLC6A5MEN1KMT2AS1PR2S1PR1
SCHEMBL7929385 0.92 S1PR2 (0.49) SLC6A5MEN1KMT2AS1PR2S1PR1
SCHEMBL23390575 0.92 S1PR2 (0.55) MEN1KMT2AALDH1A1S1PR2S1PR1

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
CN-107108461-B Perovskite nanocrystal particle and photoelectric element using same 浦项工科大学校产学协力团 2020-04-28 — — CN disclosed