SCHEMBL28889443

SCHEMBL28889443

C=C(C)C(=O)Oc1ccc(-c2cccc3[nH]nnc23)c(O)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.38
GAA P10253 4/20 0.37
MGAM O43451 3/20 0.37
SI P14410 3/20 0.37
MGAM2 Q2M2H8 3/20 0.37
KMT2A Q03164 7/20 0.33
CYP3A4 P08684 1/20 0.33
ATM Q13315 1/20 0.33
MEN1 O00255 6/20 0.32
MAPT P10636 6/20 0.32
NPSR1 Q6W5P4 6/20 0.32
TP53 P04637 5/20 0.32
ALOX12 P18054 4/20 0.32
MAPK1 P28482 4/20 0.32
USP2 O75604 4/20 0.32
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 3/20 0.32
TSHR P16473 3/20 0.31
SMN1; SMN2 Q16637 2/20 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
SCHEMBL27561443 0.82 PDE5A (0.39) ELANEGAAKMT2AATMMAPK1
SCHEMBL28926752 0.82 ELANE (0.32) ELANE
SCHEMBL29286602 0.82 CA2 (0.37) GAAMGAMSIMGAM2KMT2A
SCHEMBL5585189 0.80 GABRG2 (0.35) ELANEKMT2AMEN1MAPTNPSR1
SCHEMBL818765 0.78 ELANE (0.37) ELANEKMT2AATMMAPT
SCHEMBL27891304 0.76 GAA (0.34) GAAMGAMSIMGAM2KMT2A
SCHEMBL9801810 0.76 GAA (0.44) GAAMGAMSIMGAM2KMT2A
SCHEMBL30058937 0.76 GAA (0.44) GAAMGAMSIMGAM2KMT2A
SCHEMBL31570222 0.75 APP (0.34) MAPTMAPK1TSHR
SCHEMBL2934860 0.75 APP (0.34) MAPTMAPK1TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115215963-A Anti-blue-light corneal contact lens and preparation method thereof 江苏海伦隐形眼镜有限公司 2022-10-21 CN claimed
CN-113912775-B Indicator material and preparation method and application thereof 江苏海伦隐形眼镜有限公司 2023-01-10 CN disclosed