SCHEMBL28115311

SCHEMBL28115311

CCCCCCCCCCCC[N+](CC)(CCCC)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.40
SLC22A1 O15245 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
ALOX12 P18054 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HSP90AA1 P07900 1/20 0.38
RAD52 P43351 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL28018487 1.00 DNM1 (0.40) DNM1SLC22A1HTTKMT2AALDH1A1
SCHEMBL28017960 1.00 DNM1 (0.40) DNM1SLC22A1HTTKMT2AALDH1A1
SCHEMBL28017962 1.00 DNM1 (0.40) DNM1SLC22A1HTTKMT2AALDH1A1
SCHEMBL28235416 1.00 DNM1 (0.40) DNM1SLC22A1HTTKMT2AALDH1A1
Water SCHEMBL28204467 0.98 DNM1 (0.39) DNM1SLC22A1HTTKMT2AALDH1A1
Hydrochloric Acid SCHEMBL28186613 0.98 DNM1 (0.39) DNM1SLC22A1HTTKMT2AALDH1A1
Water SCHEMBL28220928 0.98 DNM1 (0.39) DNM1SLC22A1HTTKMT2AALDH1A1
Water SCHEMBL28220378 0.98 DNM1 (0.39) DNM1SLC22A1HTTKMT2AALDH1A1
SCHEMBL9076107 0.94 DNM1 (0.45) DNM1SLC22A1HTTKMT2AHSP90AA1
SCHEMBL27284076 0.94 DNM1 (0.45) DNM1SLC22A1HTTKMT2AHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104588130-B A kind of regeneration method of deodorization catalyst 中国石油化工股份有限公司 2018-08-28 CN disclosed
CN-106336898-B A kind of production method of low-sulphur oil 中国石油化工股份有限公司 2018-05-18 CN disclosed
CN-105562091-B Method for the catalyst aid composition and mercaptan catalyst oxidation of mercaptan catalyst oxidation 中国石油化工股份有限公司 2018-03-20 CN disclosed
CN-105567303-B Method for extraction and desulfurization of light hydrocarbon stream 中国石油化工股份有限公司 2017-05-24 CN disclosed
CN-106336898-A Method for producing low sulfur gasoline 中国石油化工股份有限公司 2017-01-18 CN disclosed
CN-104588130-A Regeneration method for deodorization catalyst CHINA PETROLEUM & CHEMICAL 2015-05-06 CN disclosed