SCHEMBL28134166

SCHEMBL28134166

CCCCC(N)CNCC

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP3A4 P08684 1/20 0.43
SLC15A1 P46059 1/20 0.38
PLA2G1B P04054 1/20 0.38
PLA2G2A P14555 1/20 0.38
OPRM1 P35372 1/20 0.37
TDP1 Q9NUW8 1/20 0.34
S1PR2 O95136 5/20 0.34
S1PR1 P21453 5/20 0.34
S1PR3 Q99500 5/20 0.34
S1PR4 O95977 4/20 0.34
DPP7 Q9UHL4 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
DNM1 Q05193 1/20 0.33

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
SCHEMBL19300979 0.84 MEN1 (0.34) TDP1DPP7
SCHEMBL17336285 0.84 TSHR (0.44) TSHRALDH1A1CYP3A4SLC15A1PLA2G1B
SCHEMBL17336278 0.82 ALDH1A1 (0.45) TSHRALDH1A1CYP3A4SLC15A1PLA2G1B
SCHEMBL13973040 0.82 GNAI3 (0.35) TSHRALDH1A1TDP1DPP7DNM1
SCHEMBL8435126 0.82 TDP1 (0.43) TSHRALDH1A1CYP3A4SLC15A1PLA2G1B
SCHEMBL30420362 0.79 TSHR (0.50) TSHRALDH1A1CYP3A4SLC15A1PLA2G1B
SCHEMBL27440938 0.79 ALDH1A1 (0.38) TSHRALDH1A1CYP3A4SLC15A1PLA2G1B
SCHEMBL5085745 0.79 CASP2 (0.41) TSHRALDH1A1CYP3A4TDP1SMN1; SMN2
SCHEMBL14528628 0.78
SCHEMBL15623972 0.78

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-106458883-A Chlorine resistant polyethylene compounds and articles made therefrom 弗纳技术股份有限公司 2017-02-22 CN claimed