SCHEMBL26499206

SCHEMBL26499206

CCCCCCCCOc1ccc(CNCC(C)=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 2/20 0.61
S1PR1 P21453 2/20 0.61
S1PR3 Q99500 2/20 0.61
LPAR2 Q9HBW0 2/20 0.61
TP53 P04637 1/20 0.54
TSHR P16473 1/20 0.54
FAAH O00519 2/20 0.53
PLA2G4B P0C869 2/20 0.52
NR5A1 Q13285 1/20 0.51
KDM4E B2RXH2 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
PDE4A P27815 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HIF1A Q16665 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL26497631 0.87 S1PR2 (0.60) S1PR2S1PR1S1PR3LPAR2TP53
SCHEMBL26497466 0.85 S1PR2 (0.57) S1PR2S1PR1S1PR3LPAR2TP53
SCHEMBL5096249 0.83 S1PR2 (0.55) S1PR2S1PR1S1PR3LPAR2FAAH
SCHEMBL9308211 0.82 FAAH (0.63) S1PR2S1PR1S1PR3LPAR2TP53
SCHEMBL25807952 0.82 S1PR2 (0.62) S1PR2S1PR1S1PR3LPAR2TP53
SCHEMBL5096244 0.81 S1PR2 (0.62) S1PR2S1PR1S1PR3LPAR2TSHR
SCHEMBL5105487 0.80 LMNA (0.57) S1PR2S1PR1S1PR3LPAR2FAAH
SCHEMBL5092458 0.80 S1PR2 (0.64) S1PR2S1PR1S1PR3LPAR2TSHR
SCHEMBL1695202 0.79 TP53 (0.60) S1PR2S1PR1S1PR3LPAR2TP53
SCHEMBL26310195 0.79 S1PR1 (0.60) S1PR2S1PR1S1PR3LPAR2TP53

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
US-20230321251-A1 LIPOSOME FORMULATION CONTAINING ANTIBACTERIAL AGENT OSAKA UNIVERSITY (JP) 2023-10-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230321251-A1 LIPOSOME FORMULATION CONTAINING ANTIBACTERIAL AGENT LIPA, LIPG, LIPC S1PR2 1128/4885S1PR1 1099/4885S1PR3 1760/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.