SCHEMBL31481273

SCHEMBL31481273

O=c1oc(=O)c2ccccc2c(=O)oc(=O)c2ccc1cc2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 10/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
NPSR1 Q6W5P4 2/20 0.52
ALDH1A1 P00352 2/20 0.52
MAPT P10636 2/20 0.52
HSD17B10 Q99714 2/20 0.52
GMNN O75496 1/20 0.52
LMNA P02545 1/20 0.52
TP53 P04637 1/20 0.52
CYP1A2 P05177 1/20 0.52
POLB P06746 1/20 0.52
CTSG P08311 1/20 0.52
CTSA P10619 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
ALOX15 P16050 1/20 0.52
NFKB1 P19838 1/20 0.52
CYP2C19 P33261 1/20 0.52
THPO P40225 1/20 0.52
MTOR P42345 1/20 0.52

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
SCHEMBL24891350 0.89 ELANE (0.61) ELANESMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL30966887 0.86 ALDH1A1 (0.58) ELANESMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL29391754 0.86 ALDH1A1 (0.58) ELANESMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL257 0.86 ALDH1A1 (0.58) ELANESMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL29599746 0.83 NPSR1 (0.57) ELANESMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL28252904 0.83 NPSR1 (0.57) ELANESMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL20963057 0.83 ELANE (0.54) ELANESMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL110031 0.83 MCL1 (0.38) ELANESMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL21173973 0.80 ELANE (0.52) ELANESMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL8520516 0.80 MCL1 (0.36) ELANESMN1; SMN2NPSR1ALDH1A1MAPT

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-119524880-A Preparation method of foam nickel-based composite material for treating oily sewage by ozone photocatalysis 北方工业大学 2025-02-28 CN disclosed