SCHEMBL31374472

SCHEMBL31374472

CCCCC(CCCC)[N+](CC)(CC)CC

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.39
TSHR P16473 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP3A4 P08684 1/20 0.33
LMNA P02545 1/20 0.33
FDPS P14324 1/20 0.33
CA2 P00918 2/20 0.32
MAPK1 P28482 1/20 0.32
OPRM1 P35372 1/20 0.32
SLC22A1 O15245 2/20 0.32
SLC22A2 O15244 1/20 0.32
THRB P10828 1/20 0.32
CA1 P00915 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
Hydrochloric Acid SCHEMBL11190139 0.83 LMNA (0.38) DNM1TSHRLMNAOPRM1SLC22A1
Iodide SCHEMBL11050168 0.79 OPRM1 (0.37) DNM1TSHRSMN1; SMN2LMNAFDPS
Hydrochloric Acid SCHEMBL28024414 0.79 THRB (0.38) TSHRALDH1A1CYP3A4LMNATHRB
Bromide SCHEMBL2992549 0.78 SLC22A1 (0.41) DNM1TSHRSMN1; SMN2ALDH1A1CYP3A4
SCHEMBL9625121 0.77 DNM1 (0.39) DNM1TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL9117364 0.76 TSHR (0.39) DNM1TSHRSMN1; SMN2ALDH1A1TDP1
Bromide SCHEMBL9625773 0.74 DNM1 (0.42) DNM1TSHRSMN1; SMN2ALDH1A1TDP1
Fluoride Ion SCHEMBL28863768 0.74 TSHR (0.38) DNM1TSHRSMN1; SMN2ALDH1A1TDP1
Fluoride Ion SCHEMBL2965514 0.74 TSHR (0.38) DNM1TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL6139813 0.72 DNM1 (0.46) DNM1TSHRSMN1; SMN2ALDH1A1CYP3A4

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-111837272-B Catalyst for fuel cell, membrane electrode assembly for fuel cell, and fuel cell provided with the membrane electrode assembly for fuel cell 斯泰拉化工公司 2025-01-14 CN disclosed