SCHEMBL7699604

SCHEMBL7699604

CN(C)c1ccc(-c2oc(-c3ccccc3-c3ccccc3)nc2C(=O)Nc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
RXFP1 Q9HBX9 1/20 0.47
ALDH1A1 P00352 5/20 0.47
CYP3A4 P08684 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KDM4E B2RXH2 4/20 0.45
GAA P10253 3/20 0.45
HIF1A Q16665 1/20 0.45
DGAT1 O75907 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL7695132 0.97 MAPT (0.49) MAPTRXFP1ALDH1A1CYP3A4TDP1
SCHEMBL7699148 0.94 MAPT (0.48) MAPTRXFP1ALDH1A1CYP3A4TDP1
SCHEMBL7701479 0.91 HSP90AA1 (0.54) MAPTRXFP1ALDH1A1CYP3A4TDP1
SCHEMBL7698114 0.90 MAPT (0.48) MAPTRXFP1ALDH1A1MEN1KMT2A
SCHEMBL7694233 0.89 SMN1; SMN2 (0.44) MAPTRXFP1ALDH1A1CYP3A4TDP1
SCHEMBL7699090 0.88 MAPT (0.40) MAPTRXFP1ALDH1A1CYP3A4TDP1
SCHEMBL7702049 0.87 DGAT1 (0.47) MAPTRXFP1ALDH1A1CYP3A4TDP1
SCHEMBL7695765 0.86 ALDH1A1 (0.50) MAPTRXFP1ALDH1A1MEN1KMT2A
SCHEMBL7695160 0.86 MAPT (0.41) MAPTRXFP1ALDH1A1CYP3A4MEN1
SCHEMBL7694375 0.86 HSD17B10 (0.40) MAPTRXFP1ALDH1A1TDP1L3MBTL1

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