SCHEMBL7694372

SCHEMBL7694372

CCOC(=O)c1nc(-c2ccc(C(C)(C)C)cc2)oc1-c1cccc([N+](=O)[O-])c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 6/20 0.48
MAPT P10636 4/20 0.48
KMT2A Q03164 2/20 0.47
RAB9A P51151 2/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 4/20 0.46
MAPK1 P28482 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PDCD4 Q53EL6 1/20 0.43
IKBKB O14920 1/20 0.42
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42

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
SCHEMBL29158742 0.92 TARBP2 (0.47) TARBP2MAPTKMT2ARAB9AMEN1
SCHEMBL7695426 0.89 GAA (0.49) TARBP2MAPTKMT2ARAB9AMEN1
SCHEMBL7698153 0.84 TARBP2 (0.52) TARBP2MAPTKMT2ARAB9AMEN1
SCHEMBL29158624 0.84 TARBP2 (0.65) TARBP2MAPTKMT2ARAB9AALDH1A1
SCHEMBL7694123 0.83 KDM4E (0.53) TARBP2MAPTKMT2AALDH1A1KDM4E
SCHEMBL30106264 0.82 TARBP2 (0.49) TARBP2KMT2ARAB9AALDH1A1SMN1; SMN2
SCHEMBL7695771 0.82 TARBP2 (0.49) TARBP2KMT2ARAB9AALDH1A1SMN1; SMN2
SCHEMBL7699591 0.82 TARBP2 (0.62) TARBP2MAPTKMT2ARAB9AALDH1A1
SCHEMBL29158611 0.82 TARBP2 (0.62) TARBP2MAPTKMT2ARAB9AALDH1A1
SCHEMBL7693600 0.81 TARBP2 (0.48) TARBP2MAPTKMT2ARAB9AMEN1

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-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO disclosed