SCHEMBL22857722

SCHEMBL22857722

CCCCCCCNCCCCCCCCCC1CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
TSHR P16473 1/20 0.56
GNAI3 P08754 2/20 0.50
GNAO1 P09471 2/20 0.50
GNAI1 P63096 2/20 0.50
SIGMAR1 Q99720 2/20 0.48
CYP1A2 P05177 1/20 0.46
SAT1 P21673 1/20 0.45
TP53 P04637 1/20 0.43
S1PR2 O95136 5/20 0.42
S1PR4 O95977 5/20 0.42
S1PR1 P21453 5/20 0.42
S1PR3 Q99500 5/20 0.42
S1PR5 Q9H228 1/20 0.42
EPHX1 P07099 2/20 0.42
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41

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
SCHEMBL19594869 1.00 ALDH1A1 (0.56) ALDH1A1TSHRGNAI3GNAO1GNAI1
SCHEMBL22216929 0.91 SIGMAR1 (0.48) ALDH1A1TSHRGNAI3GNAO1GNAI1
SCHEMBL30947779 0.91 GNAI3 (0.47) ALDH1A1TSHRGNAI3GNAO1GNAI1
SCHEMBL22651943 0.90 SIGMAR1 (0.63) ALDH1A1TSHRGNAI3GNAO1GNAI1
SCHEMBL9211603 0.88 CYP1A2 (0.59) ALDH1A1TSHRGNAI3GNAO1GNAI1
SCHEMBL9210935 0.88 CYP1A2 (0.59) ALDH1A1TSHRGNAI3GNAO1GNAI1
SCHEMBL21203154 0.88 GNAI3 (0.47) ALDH1A1TSHRGNAI3GNAO1GNAI1
SCHEMBL9207589 0.88 SIGMAR1 (0.60) ALDH1A1TSHRGNAI3GNAO1GNAI1
SCHEMBL31560046 0.87 SAT1 (0.50) ALDH1A1TSHRGNAI3GNAO1GNAI1
SCHEMBL2048536 0.86

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-2021000041-A1 IONIZABLE LIPIDS FOR NUCLEIC ACID DELIVERY Precision Nanosystems Inc. (CA) 2021-01-07 WO disclosed