SCHEMBL7700372

SCHEMBL7700372

CCN(C(=O)c1nc(-c2ccccc2-c2ccccc2)oc1-c1ccc(N(C)C)cc1)c1ccc2c(c1)OCO2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
GAA P10253 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
RECQL P46063 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
GABRA1 P14867 2/20 0.38
GABRB2 P47870 2/20 0.38
ADORA1 P30542 4/20 0.38

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
SCHEMBL7702691 0.93 HPGD (0.43) HPGDALDH1A1MAPTKDM4ELMNA
SCHEMBL7701529 0.82 POLB (0.52) HPGDALDH1A1MAPTKDM4ELMNA
SCHEMBL7700069 0.82 KDM4E (0.45) HPGDALDH1A1MAPTKDM4ELMNA
SCHEMBL7704549 0.80 ALDH1A1 (0.39) HPGDALDH1A1MAPTKDM4ELMNA
SCHEMBL7698850 0.77 GPBAR1 (0.39) HPGDALDH1A1MAPTKDM4EMEN1
SCHEMBL7695160 0.77 MAPT (0.41) HPGDALDH1A1MAPTKDM4ELMNA
SCHEMBL7700374 0.76 ALDH1A1 (0.32) HPGDALDH1A1KDM4EMEN1KMT2A
SCHEMBL7698049 0.75 ALDH1A1 (0.57) HPGDALDH1A1MAPTKDM4EKMT2A
SCHEMBL7695167 0.75 MAPT (0.40) HPGDALDH1A1MAPTKDM4ELMNA
SCHEMBL7699568 0.74 GPBAR1 (0.44) HPGDALDH1A1MAPTKDM4ELMNA

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