SCHEMBL29158993

SCHEMBL29158993

CCOC(=O)c1nc(-c2ccc(-c3ccccc3)cc2)oc1-c1ccccc1[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 7/20 0.61
ALDH1A1 P00352 5/20 0.54
KDM4E B2RXH2 3/20 0.54
HSD17B10 Q99714 3/20 0.54
HPGD P15428 2/20 0.54
KMT2A Q03164 1/20 0.54
PDCD4 Q53EL6 1/20 0.47
PTGS1 P23219 1/20 0.42
PTGS2 P35354 1/20 0.42
MAPT P10636 2/20 0.42
EIF4E P06730 2/20 0.41
PKM P14618 1/20 0.41
ALOX15 P16050 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL20361981 0.98 TARBP2 (0.58) TARBP2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL29158785 0.93 TARBP2 (0.52) TARBP2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL29158670 0.92 TARBP2 (0.51) TARBP2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL21541935 0.92 TARBP2 (0.59) TARBP2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL30740865 0.92 TARBP2 (0.59) TARBP2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL30740866 0.91 TARBP2 (0.60) TARBP2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL21541932 0.91 TARBP2 (0.60) TARBP2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL29158733 0.90 KDM4E (0.53) TARBP2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL29158571 0.90 TARBP2 (0.49) TARBP2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL30106264 0.90 TARBP2 (0.49) TARBP2ALDH1A1KDM4EHSD17B10HPGD

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-117396465-A Novel oxazole derivative for preventing or treating allergic diseases and pharmaceutical composition containing the same 阿斯克里斯有限公司 2024-01-12 CN disclosed